data_1m7l_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 1m7l _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 5' ' ' VAL . . . . . 0.52 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 78.5 t . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.59 -23.64 65.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.093 178.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 52.8 m -72.73 -21.26 61.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.571 0.7 . . . . 0.0 110.475 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.7 tp -76.56 -18.72 58.52 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 5.6 mpt_? -73.8 -40.21 63.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.564 178.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 7' ' ' SER . 4.0 pt20 -71.93 -30.35 65.24 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.579 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 37.4 tt0 -69.63 -28.62 66.06 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 122.116 0.96 . . . . 0.0 108.479 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 t -74.48 -32.73 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 114.273 -1.33 . . . . 0.0 109.444 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.643 ' HA ' HE21 ' A' ' 16' ' ' GLN . 51.0 mt-10 -71.31 -26.54 62.89 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.32 -41.19 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.477 177.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.549 HD13 ' HA ' ' B' ' 56' ' ' GLN . 37.3 tp -63.47 -38.42 91.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.385 -1.28 . . . . 0.0 110.107 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.643 HE21 ' HA ' ' A' ' 13' ' ' GLU . 26.2 pt20 -77.0 -21.27 54.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.844 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.858 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -71.36 -33.68 64.28 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.657 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 3.8 mm100 -70.65 -44.6 66.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.472 -0.364 . . . . 0.0 110.474 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.527 HG12 ' CD1' ' C' ' 95' ' ' LEU . 8.1 p -70.12 -31.69 48.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.734 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.858 HE21 ' HA2' ' A' ' 17' ' ' GLY . 19.2 pt20 -71.91 -38.73 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.4 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.657 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 12.0 p-80 -79.96 -18.0 51.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.197 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.695 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 1.8 mp -79.47 -28.81 41.55 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.55 ' HG2' HD13 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -76.97 -29.11 55.4 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 21' ' ' HIS . . . -60.01 -60.92 3.07 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.581 177.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.4 94.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.542 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.695 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.04 -28.12 56.1 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.898 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t -60.07 -31.96 70.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.226 0.536 . . . . 0.0 110.77 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -76.82 -48.16 19.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.586 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.715 ' HA ' HG21 ' A' ' 32' ' ' VAL . 34.5 m-85 -70.89 -15.55 62.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.537 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 37.2 ttmt -66.17 -40.64 90.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.21 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -97.98 32.41 2.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.738 0.78 . . . . 0.0 110.123 178.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.715 HG21 ' HA ' ' A' ' 29' ' ' TYR . 6.6 t -94.81 -36.41 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.265 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -101.89 103.75 14.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 122.493 1.14 . . . . 0.0 110.498 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.729 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.3 -1.553 0 CA-C-N 112.566 -2.106 . . . . 0.0 108.991 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.523 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 70.7 t . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.534 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.52 -23.97 65.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.158 178.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.683 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.9 m -72.21 -22.09 61.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.436 0.636 . . . . 0.0 110.526 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 23.4 tp -75.82 -18.51 59.45 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 5.4 mpt_? -74.1 -39.38 63.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.516 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.683 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.7 pt20 -72.42 -30.77 64.93 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.566 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.6 tt0 -69.14 -28.25 66.28 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.105 0.955 . . . . 0.0 108.518 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -75.32 -32.74 26.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 114.44 -1.254 . . . . 0.0 109.453 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.616 ' HA ' HE21 ' B' ' 56' ' ' GLN . 49.0 mt-10 -70.94 -26.39 63.17 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.92 -42.03 73.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.447 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.534 HD13 ' HA ' ' C' ' 96' ' ' GLN . 37.1 tp -63.07 -38.38 90.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.334 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.616 HE21 ' HA ' ' B' ' 53' ' ' GLU . 25.4 pt20 -76.95 -20.77 55.74 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.836 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.838 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -72.13 -33.64 62.02 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 177.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.636 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 3.5 mm100 -70.04 -44.75 68.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.954 0.407 . . . . 0.0 110.357 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.534 HG12 ' CD1' ' A' ' 15' ' ' LEU . 8.2 p -69.89 -32.12 50.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.891 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.838 HE21 ' HA2' ' B' ' 57' ' ' GLY . 17.6 pt20 -71.89 -38.77 69.93 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.347 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.636 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 11.3 p-80 -79.78 -17.68 52.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.41 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.715 ' O ' ' HB2' ' B' ' 66' ' ' PHE . 1.9 mp -79.93 -29.12 39.67 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.536 ' HG2' HD13 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -75.85 -29.22 58.49 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.322 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.567 ' HB2' ' O ' ' B' ' 61' ' ' HIS . . . -59.85 -61.66 2.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.627 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.53 89.78 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.66 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.715 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.94 -29.15 59.69 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.108 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.5 t -58.56 -34.06 70.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.004 0.366 . . . . 0.0 110.648 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.417 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 5.1 mm100 -75.21 -47.92 25.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.328 0.585 . . . . 0.0 109.9 178.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.725 ' HA ' HG21 ' B' ' 72' ' ' VAL . 33.9 m-85 -70.94 -16.13 62.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 37.1 ttmt -66.51 -39.98 88.97 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.443 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.401 ' O ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -98.23 31.39 2.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.684 0.754 . . . . 0.0 109.908 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.725 HG21 ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -93.82 -36.66 7.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.267 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.401 ' HB2' HG23 ' A' ' 32' ' ' VAL . 37.8 tt0 -102.25 101.86 12.19 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.532 1.158 . . . . 0.0 111.145 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.723 HD23 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.722 0 CA-C-N 112.411 -2.177 . . . . 0.0 108.837 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.56 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 76.3 t . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.55 -24.14 65.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.247 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.656 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 56.1 m -72.01 -22.02 61.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.539 0.685 . . . . 0.0 110.207 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.607 ' O ' HG13 ' C' ' 92' ' ' VAL . 25.6 tp -75.69 -19.12 59.34 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.574 ' O ' HG23 ' C' ' 92' ' ' VAL . 4.6 mpt_? -75.94 -36.94 59.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.313 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' C' ' 87' ' ' SER . 4.0 pt20 -73.26 -29.49 62.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.496 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.5 tt0 -69.77 -30.33 67.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 177.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.607 HG13 ' O ' ' C' ' 88' ' ' LEU . 16.0 m -75.85 -27.9 18.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.738 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.654 ' HA ' HE21 ' C' ' 96' ' ' GLN . 52.3 mt-10 -70.26 -28.17 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -70.11 -41.0 74.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.542 177.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.54 HD13 ' HA ' ' A' ' 16' ' ' GLN . 40.2 tp -63.77 -37.52 87.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.27 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.654 HE21 ' HA ' ' C' ' 93' ' ' GLU . 26.2 pt20 -77.69 -21.35 52.16 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.727 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.846 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -71.22 -34.07 64.51 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.658 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 3.1 mm100 -69.84 -44.87 69.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.317 178.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.53 HG12 ' CD1' ' B' ' 55' ' ' LEU . 10.0 p -70.22 -30.99 45.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.104 -0.639 . . . . 0.0 112.204 -178.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.846 HE21 ' HA2' ' C' ' 97' ' ' GLY . 19.2 pt20 -72.69 -38.86 67.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.001 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.658 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 12.3 p-80 -80.07 -17.16 53.41 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 119.448 -0.901 . . . . 0.0 110.21 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.614 ' O ' ' HB2' ' C' ' 106' ' ' PHE . 1.8 mp -79.79 -29.27 40.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.483 ' HG2' HD13 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -76.91 -28.83 55.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 176.359 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' C' ' 101' ' ' HIS . . . -59.84 -61.86 2.3 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.514 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.12 -41.5 88.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.648 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.614 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.01 -31.44 61.05 Favored 'General case' 0 C--O 1.204 -1.313 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.724 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.4 t -55.74 -34.62 65.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.902 0.382 . . . . 0.0 110.728 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -75.38 -49.11 20.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.302 0.572 . . . . 0.0 109.967 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.718 ' HA ' HG21 ' C' ' 112' ' ' VAL . 32.7 m-85 -70.36 -16.13 62.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.792 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' C' ' 106' ' ' PHE . 30.1 ttmt -69.32 -34.67 75.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.647 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.5 30.66 4.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.452 0.644 . . . . 0.0 109.582 177.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.718 HG21 ' HA ' ' C' ' 109' ' ' TYR . 5.2 t -93.47 -37.25 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.337 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.417 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 37.2 tt0 -101.45 102.71 13.55 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-O 122.404 1.097 . . . . 0.0 110.559 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.715 HD23 ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.63 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.792 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.734 0.302 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.626 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.86 -27.34 68.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.511 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.684 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 75.2 m -67.7 -28.46 67.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.07 0.462 . . . . 0.0 109.847 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.2 tp -75.48 -21.66 57.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.622 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 39.0 mmm-85 -65.4 -21.53 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 7' ' ' SER . 6.6 mt-30 -73.39 -42.83 61.66 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -70.86 -29.29 65.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.782 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 9' ' ' ARG . 28.3 m -76.42 -40.87 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.634 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.82 -24.13 61.67 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -55.29 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.552 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.605 HD12 ' HA ' ' B' ' 56' ' ' GLN . 12.3 tp -58.92 -34.12 71.36 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.295 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HA ' HD22 ' C' ' 95' ' ' LEU . 15.4 tt0 -67.12 -38.31 85.37 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.484 179.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.489 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -61.4 -31.72 78.39 Favored Glycine 0 C--O 1.237 0.324 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.753 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.67 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 95.6 mm-40 -72.94 -49.95 26.37 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 16' ' ' GLN . 10.2 p -66.41 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.3 pt20 -68.88 -42.97 76.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.099 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.54 ' HA ' ' HB1' ' A' ' 24' ' ' ALA . 6.8 p-80 -75.81 -17.29 59.9 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.8 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' B' ' 63' ' ' GLN . 12.3 mt -73.57 -37.3 65.56 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 176.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.795 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.6 tm0? -70.65 -29.26 65.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.54 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -58.38 -62.13 2.07 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.086 178.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.15 92.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.08 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.596 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -56.04 -28.98 59.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.12 -179.85 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.0 t -61.6 -31.88 71.96 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.028 0.442 . . . . 0.0 110.259 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -73.97 -52.04 14.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.59 0.71 . . . . 0.0 109.508 178.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.541 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 56.8 m-85 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.238 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.29 -41.1 98.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.851 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -96.36 29.67 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.49 0.662 . . . . 0.0 111.272 179.56 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 3.5 t -96.3 -41.12 11.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.594 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.483 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 19.3 tt0 -102.74 105.43 15.87 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.63 0.729 . . . . 0.0 109.833 177.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.652 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.615 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.36 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 86.4 t . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.24 -27.62 68.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.443 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 69.7 m -67.68 -27.89 67.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.011 0.434 . . . . 0.0 109.965 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.46 -21.56 58.0 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.574 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.604 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 39.5 mmm-85 -65.38 -21.97 66.74 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' B' ' 47' ' ' SER . 5.8 mt-30 -72.99 -42.09 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.623 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -71.85 -28.48 63.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.51 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.567 HG22 ' O ' ' B' ' 49' ' ' ARG . 30.4 m -77.06 -42.25 31.65 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.444 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.95 -25.3 63.57 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.13 -55.2 17.59 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' C' ' 96' ' ' GLN . 12.5 tp -59.27 -33.5 71.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.382 -1.281 . . . . 0.0 110.251 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.605 ' HA ' HD12 ' A' ' 15' ' ' LEU . 14.3 tt0 -67.15 -39.2 86.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.521 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.499 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -61.06 -31.72 77.72 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.766 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.688 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 96.0 mm-40 -72.76 -49.5 30.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.02 0.438 . . . . 0.0 111.114 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.467 HG11 ' O ' ' B' ' 56' ' ' GLN . 9.8 p -66.99 -32.18 56.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 8.0 pt20 -69.96 -42.87 72.6 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.986 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.545 ' HA ' ' HB1' ' B' ' 64' ' ' ALA . 6.8 p-80 -75.74 -17.29 59.96 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.671 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.735 HD21 ' HG2' ' C' ' 103' ' ' GLN . 12.0 mt -73.34 -37.11 66.22 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.75 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.2 tm0? -70.6 -29.98 66.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.545 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -57.39 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.068 178.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -40.99 88.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.134 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.603 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.2 OUTLIER -56.62 -28.7 61.06 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.225 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.1 t -62.0 -30.68 71.11 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.212 0.53 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -75.07 -51.21 14.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.584 0.706 . . . . 0.0 109.389 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.542 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 61.0 m-85 -66.28 -16.42 64.01 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.299 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.67 -41.79 98.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.879 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.483 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -95.83 29.42 2.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.362 0.601 . . . . 0.0 111.543 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' B' ' 69' ' ' TYR . 3.6 t -96.28 -40.24 10.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.457 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.47 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 19.1 tt0 -103.68 105.36 15.56 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 122.011 0.91 . . . . 0.0 109.922 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.679 ' N ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.658 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.316 -179.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.456 -0.163 0 CA-C-O 120.572 0.225 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.42 -26.97 68.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.394 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 75.5 m -68.07 -28.32 67.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 0.0 109.956 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.36 -21.54 58.26 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.333 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 42.6 mmm-85 -63.92 -23.65 67.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.694 178.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' C' ' 87' ' ' SER . 5.8 mt-30 -72.48 -44.55 62.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.169 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -69.26 -27.46 65.45 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.788 0.804 . . . . 0.0 110.795 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.27 -45.11 35.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.525 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.4 -21.8 61.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -55.47 13.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.375 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.56 HD22 ' HA ' ' A' ' 16' ' ' GLN . 1.4 mt -56.46 -38.18 71.31 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.118 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.636 ' HA ' HD12 ' B' ' 55' ' ' LEU . 17.0 tt0 -64.23 -38.98 92.97 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.163 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.498 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.88 -31.65 79.12 Favored Glycine 0 C--O 1.238 0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.587 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.683 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 96.2 mm-40 -73.04 -50.04 25.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 111.189 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.401 HG11 ' O ' ' C' ' 96' ' ' GLN . 9.6 p -66.37 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.59 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 8.0 pt20 -68.94 -43.41 75.12 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.026 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.552 ' HA ' ' HB1' ' C' ' 104' ' ' ALA . 6.6 p-80 -75.53 -17.06 60.19 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.967 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.795 HD21 ' HG2' ' A' ' 23' ' ' GLN . 12.8 mt -74.25 -36.62 63.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.735 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.1 tm0? -70.94 -29.18 65.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.552 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -58.19 -63.07 1.39 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.829 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.39 -42.01 90.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.136 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.622 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.2 OUTLIER -55.57 -29.1 58.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.174 -0.921 . . . . 0.0 112.308 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 10.6 t -61.98 -30.62 71.06 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.028 0.442 . . . . 0.0 110.653 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -75.56 -51.1 13.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.594 0.712 . . . . 0.0 109.401 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.655 ' HA ' HG12 ' C' ' 112' ' ' VAL . 58.7 m-85 -66.03 -17.38 64.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.016 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -60.76 -39.49 88.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.08 -0.963 . . . . 0.0 110.907 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.483 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.56 26.64 4.83 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.655 HG12 ' HA ' ' C' ' 109' ' ' TYR . 1.1 m -99.41 -30.58 3.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.816 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.483 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 18.4 tt0 -102.95 103.22 13.33 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 121.922 0.868 . . . . 0.0 109.566 176.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.671 ' N ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.3 -1.573 0 CA-C-N 113.399 -1.728 . . . . 0.0 110.329 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.552 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 85.2 t . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.681 0.277 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.28 -33.47 69.79 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.704 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -69.45 -20.25 63.76 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.416 1.103 . . . . 0.0 108.294 177.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.552 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 28.6 tp -76.3 -29.65 57.43 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.323 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.674 ' HA ' HG13 ' A' ' 12' ' ' VAL . 22.6 mmm-85 -66.37 -39.94 89.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.074 0.464 . . . . 0.0 109.997 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -69.76 -41.93 74.54 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.14 179.694 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.451 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 7.4 tt0 -66.62 -34.94 79.0 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.104 0.478 . . . . 0.0 111.377 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.674 HG13 ' HA ' ' A' ' 9' ' ' ARG . 5.7 p -76.97 -30.88 18.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' N ' HG12 ' A' ' 12' ' ' VAL . 37.2 tt0 -69.98 -30.56 67.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.47 -56.29 13.22 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.716 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.486 ' O ' HG21 ' A' ' 19' ' ' VAL . 28.2 tp -58.39 -34.52 70.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.054 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -65.27 -44.29 88.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.688 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.52 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -61.13 -31.31 76.33 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.625 179.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.722 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 69.8 mt-30 -71.95 -43.71 64.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.898 0.38 . . . . 0.0 110.584 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.486 HG21 ' O ' ' A' ' 15' ' ' LEU . 58.2 t -67.52 -40.93 85.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.839 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.8 pt20 -61.98 -42.12 98.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.059 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.472 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.3 p-80 -79.78 -17.16 54.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.771 -0.772 . . . . 0.0 111.024 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 11.5 mt -71.64 -41.19 69.1 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.423 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -70.82 -31.97 68.88 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.66 -55.43 34.98 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.755 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -61.89 -39.94 93.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.693 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -55.05 -29.67 57.97 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.381 179.43 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -49.83 -26.87 4.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.029 0.442 . . . . 0.0 111.122 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.418 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 4.9 mm100 -96.66 -42.82 7.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.921 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.607 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.1 m-85 -73.58 -20.4 60.63 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -178.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.458 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 51.5 mtmt -70.38 -26.95 63.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.78 0.324 . . . . 0.0 110.64 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.64 31.6 5.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.74 0.781 . . . . 0.0 109.738 178.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.607 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 2.9 t -93.38 -42.12 12.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.238 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -97.71 100.05 11.43 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 122.336 1.065 . . . . 0.0 110.687 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.517 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.69 0 CA-C-N 112.742 -2.026 . . . . 0.0 109.615 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.526 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 99.9 t . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.77 0.319 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.561 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -71.2 -33.74 70.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.722 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 48.3 m -69.51 -20.6 63.71 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 122.373 1.082 . . . . 0.0 108.611 176.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.526 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 28.7 tp -75.95 -30.04 58.52 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.033 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.656 ' HA ' HG13 ' B' ' 52' ' ' VAL . 22.6 mmm-85 -66.21 -39.12 89.39 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.158 0.504 . . . . 0.0 110.319 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.722 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -70.24 -42.65 71.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.016 179.851 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.454 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 7.5 tt0 -65.55 -35.58 81.26 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.455 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.656 HG13 ' HA ' ' B' ' 49' ' ' ARG . 5.4 p -76.52 -30.24 19.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.757 -178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.419 ' N ' HG12 ' B' ' 52' ' ' VAL . 37.4 tt0 -70.86 -29.88 66.11 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -66.43 -56.3 11.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.454 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.491 ' O ' HG21 ' B' ' 59' ' ' VAL . 27.3 tp -58.0 -34.47 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.039 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -65.21 -45.09 86.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.571 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.487 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -60.07 -31.91 74.24 Favored Glycine 0 C--O 1.236 0.26 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.605 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.727 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.8 mt-30 -71.3 -44.01 65.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 110.681 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.491 HG21 ' O ' ' B' ' 55' ' ' LEU . 59.0 t -67.35 -40.18 84.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.7 pt20 -63.2 -41.95 99.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.339 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.468 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.99 -18.11 54.23 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.676 -0.809 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 11.4 mt -71.14 -40.33 71.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.43 ' HG2' HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -71.8 -31.77 66.91 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.7 -55.41 35.19 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.847 177.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.473 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -61.88 -40.91 97.02 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.636 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -54.73 -29.12 52.66 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.573 179.306 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.8 t -50.35 -27.76 6.81 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 111.109 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.456 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 4.3 mm100 -95.41 -42.47 8.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.893 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.618 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 15.2 m-85 -74.06 -19.49 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.527 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 51.7 mtmt -71.11 -26.62 63.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.612 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.456 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -106.69 31.57 5.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.682 0.753 . . . . 0.0 109.666 178.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.618 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 3.0 t -93.44 -42.51 13.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.991 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -96.86 100.7 12.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.229 1.014 . . . . 0.0 110.846 178.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.512 ' N ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.7 0 CA-C-N 112.653 -2.067 . . . . 0.0 109.795 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.577 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 96.0 t . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.57 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.25 -34.52 70.83 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.2 m -69.23 -20.79 63.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.264 1.031 . . . . 0.0 108.312 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.615 ' O ' HG23 ' C' ' 92' ' ' VAL . 30.2 tp -74.64 -31.7 62.05 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.991 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.622 ' O ' HG22 ' C' ' 92' ' ' VAL . 23.5 mmm-85 -64.87 -40.15 94.69 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.663 0.602 . . . . 0.0 110.524 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.83 -42.0 82.14 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.47 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 7.8 tt0 -64.76 -37.05 86.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.077 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.622 HG22 ' O ' ' C' ' 89' ' ' ARG . 0.0 OUTLIER -70.79 -38.82 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.603 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.35 -31.13 71.72 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -67.1 -57.54 6.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.792 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.502 ' O ' HG21 ' C' ' 99' ' ' VAL . 26.7 tp -57.83 -34.69 69.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.297 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -65.23 -44.83 86.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.489 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.422 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.21 -31.55 73.73 Favored Glycine 0 C--O 1.238 0.388 0 N-CA-C 111.629 -0.588 . . . . 0.0 111.629 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.721 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 71.9 mt-30 -72.52 -43.65 63.27 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.643 -0.328 . . . . 0.0 110.532 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.502 HG21 ' O ' ' C' ' 95' ' ' LEU . 59.6 t -67.63 -40.11 83.49 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.422 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 3.7 pt20 -62.87 -42.37 99.74 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.313 -0.155 . . . . 0.0 111.12 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.503 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 6.6 p-80 -79.24 -17.32 54.99 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.966 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 11.0 mt -71.51 -40.73 69.96 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 177.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.438 ' HG2' HD23 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.19 -32.27 68.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.54 -54.95 41.01 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.936 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.477 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -62.28 -40.34 95.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.554 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.525 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -54.89 -29.32 55.47 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.473 179.028 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.8 t -49.64 -27.19 4.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.91 0.386 . . . . 0.0 111.298 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -96.16 -43.31 7.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.924 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.594 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -73.38 -20.36 60.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.525 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 49.8 mtmt -70.74 -25.8 63.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.675 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.505 ' HA ' HD22 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -108.48 32.8 4.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.823 0.82 . . . . 0.0 109.516 178.147 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.594 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 3.0 t -93.79 -42.87 13.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.861 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.495 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 32.3 tt0 -96.73 99.55 11.14 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.35 1.072 . . . . 0.0 111.149 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.505 HD22 ' HA ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.767 0 CA-C-N 112.523 -2.126 . . . . 0.0 109.397 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 84.0 t . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.753 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.88 -27.97 62.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.606 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.678 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 57.1 p -72.64 -19.63 61.41 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.439 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 57.9 tp -78.96 -24.13 44.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.354 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.753 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -65.82 -47.69 74.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.678 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.6 OUTLIER -65.37 -42.19 92.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.95 179.54 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -62.04 -34.32 76.02 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.374 0.607 . . . . 0.0 110.141 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.46 -31.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.299 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 51.5 mt-10 -66.88 -30.41 70.57 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -53.1 27.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.316 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.528 ' O ' HG21 ' A' ' 19' ' ' VAL . 74.7 mt -58.8 -34.21 71.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.151 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.63 -46.86 74.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.502 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.507 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.06 -31.9 74.2 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.54 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.725 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.0 mt-30 -71.3 -46.88 59.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.839 0.352 . . . . 0.0 110.745 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.528 HG21 ' O ' ' A' ' 15' ' ' LEU . 89.5 t -64.46 -42.36 95.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.4 pt20 -62.36 -42.71 99.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.391 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.436 ' HD1' ' HA ' ' A' ' 18' ' ' GLN . 4.6 p-80 -78.01 -16.65 57.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.966 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.725 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.2 mt -72.0 -41.96 66.99 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.639 ' HG2' HD22 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -66.4 -36.12 82.04 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.46 -54.9 40.31 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.887 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.422 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -60.05 -41.86 93.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.367 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 4.3 m-85 -53.7 -32.17 50.85 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.646 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.9 t -49.71 -30.53 9.44 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.417 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 13.3 mm100 -91.62 -42.24 10.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.603 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.527 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 38.6 m-85 -73.33 -20.42 60.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.968 0.413 . . . . 0.0 111.37 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.529 ' HD2' ' O ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -63.23 -32.85 74.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.265 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.55 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -104.14 23.91 12.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.396 0.617 . . . . 0.0 110.548 178.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.566 HG12 ' CG1' ' B' ' 72' ' ' VAL . 0.9 OUTLIER -93.74 -23.34 5.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.589 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' H ' ' A' ' 34' ' ' LEU . 72.8 tt0 -81.22 -126.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' A' ' 31' ' ' LYS . 3.0 mt . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.434 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 86.8 t . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.769 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.88 -27.1 61.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.882 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.676 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 49.6 p -73.92 -19.18 60.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 56.3 tp -78.89 -22.93 45.21 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.239 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.769 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -67.07 -47.66 70.61 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.676 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.7 OUTLIER -64.88 -43.07 94.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.774 179.326 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.23 -34.42 75.09 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.609 0.719 . . . . 0.0 110.395 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -78.08 -30.42 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.366 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 51.6 mt-10 -68.06 -29.52 68.51 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.08 21.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.9 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.52 ' O ' HG21 ' B' ' 59' ' ' VAL . 77.8 mt -58.56 -34.03 70.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.194 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -67.02 -46.89 73.1 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.655 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.532 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.89 -32.05 73.86 Favored Glycine 0 C--O 1.236 0.269 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.478 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.714 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 74.5 mt-30 -70.96 -47.55 58.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.764 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.52 HG21 ' O ' ' B' ' 55' ' ' LEU . 94.9 t -64.11 -41.85 93.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.532 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.5 pt20 -62.51 -43.31 99.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.443 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -77.31 -16.67 58.84 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.1 mt -72.01 -41.97 66.94 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.637 ' HG2' HD22 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.38 -36.48 82.96 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.615 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.17 -55.42 33.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.665 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.421 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -59.25 -42.07 90.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.51 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 4.3 m-85 -53.86 -32.7 53.99 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.658 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 47.7 t -48.17 -32.91 7.64 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.068 0.461 . . . . 0.0 111.054 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.422 ' O ' ' HE3' ' B' ' 71' ' ' LYS . 12.8 mm100 -89.63 -41.86 11.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.871 0.367 . . . . 0.0 111.894 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.527 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 41.0 m-85 -72.76 -21.8 60.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.548 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.491 ' HD2' ' O ' ' B' ' 70' ' ' LYS . 0.4 OUTLIER -62.36 -33.63 75.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.187 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.526 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -103.47 23.61 12.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.465 0.65 . . . . 0.0 110.544 178.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.566 ' CG1' HG12 ' A' ' 32' ' ' VAL . 1.0 OUTLIER -93.27 -23.29 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.485 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.479 ' HG2' ' H ' ' B' ' 74' ' ' LEU . 71.9 tt0 -81.28 -127.01 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.526 HD11 ' HA ' ' B' ' 71' ' ' LYS . 2.7 mt . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.444 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 86.4 t . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.78 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -73.1 -27.34 61.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.855 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.661 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 53.8 p -73.13 -19.26 61.17 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 55.8 tp -79.19 -23.22 43.99 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.468 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.78 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.6 OUTLIER -66.67 -47.67 71.74 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.661 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.6 OUTLIER -65.23 -42.9 92.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.85 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -61.2 -34.94 75.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.5 0.667 . . . . 0.0 110.249 179.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.14 -30.88 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.389 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 53.0 mt-10 -68.1 -30.54 69.74 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.39 -53.1 32.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.172 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.522 ' O ' HG21 ' C' ' 99' ' ' VAL . 70.9 mt -59.02 -34.04 71.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.214 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -67.02 -46.68 73.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.691 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.512 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -60.08 -32.12 74.94 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.714 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 74.6 mt-30 -70.78 -47.58 58.8 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 120.886 0.374 . . . . 0.0 110.775 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.522 HG21 ' O ' ' C' ' 95' ' ' LEU . 87.8 t -64.01 -41.68 93.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 2.5 pt20 -63.16 -42.38 99.41 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.442 ' HD1' ' HA ' ' C' ' 98' ' ' GLN . 5.1 p-80 -78.14 -16.99 57.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.809 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 10.5 mt -71.35 -41.51 69.67 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.645 ' HG2' HD22 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -66.65 -36.8 83.43 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.68 -54.7 41.01 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.665 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.61 -42.07 96.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.393 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.501 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 4.4 m-85 -53.73 -31.75 49.48 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.655 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.5 t -49.77 -32.19 13.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.413 ' O ' ' HE3' ' C' ' 111' ' ' LYS . 13.1 mm100 -89.47 -43.16 11.04 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.642 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.894 ' HA ' HG11 ' C' ' 112' ' ' VAL . 38.0 m-85 -72.7 -20.76 61.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 111.409 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HD2' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -62.48 -29.54 70.61 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -106.22 19.88 19.83 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.074 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.894 HG11 ' HA ' ' C' ' 109' ' ' TYR . 34.7 m -92.17 -19.14 7.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.312 177.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -76.46 -124.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.338 0.098 0 CA-C-O 121.765 0.793 . . . . 0.0 112.6 177.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.408 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 60.3 t . . . . . 0 CA--C 1.53 0.19 0 CA-C-O 120.77 0.319 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.72 -26.67 62.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.967 0.413 . . . . 0.0 110.551 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.547 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 65.1 m -70.89 -19.29 62.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.851 0.834 . . . . 0.0 108.995 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.569 HD13 HG11 ' B' ' 52' ' ' VAL . 67.6 tp -76.64 -23.69 53.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.781 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.65 ' O ' HG13 ' A' ' 12' ' ' VAL . 1.6 mmt85 -67.98 -32.63 73.18 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -70.87 -47.82 57.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.734 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.506 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 39.5 tt0 -63.25 -32.36 73.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.838 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 9' ' ' ARG . 1.1 p -77.02 -32.52 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.109 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 44.0 mt-10 -70.78 -27.36 63.86 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -68.81 -53.69 20.17 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.48 -1.237 . . . . 0.0 109.288 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.564 HD13 ' HB2' ' B' ' 56' ' ' GLN . 77.0 mt -57.62 -33.33 68.13 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.384 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.553 ' HB2' HD13 ' C' ' 95' ' ' LEU . 17.8 tt0 -69.75 -44.35 70.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.8 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -60.99 -31.52 76.78 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.612 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.72 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -73.77 -46.83 43.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.4 p -69.86 -31.09 46.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.749 -178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -71.42 -40.47 70.42 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.171 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.548 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.1 p-80 -79.77 -18.65 50.53 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.888 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.72 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.5 mt -73.37 -39.45 65.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.675 ' HG3' HD13 ' C' ' 102' ' ' LEU . 37.5 tt0 -65.99 -41.36 91.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.326 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.67 -46.79 74.1 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.263 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -63.81 -38.13 89.95 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.876 -1.057 . . . . 0.0 110.437 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.736 ' HB3' ' HG3' ' A' ' 30' ' ' LYS . 3.8 m-85 -59.24 -20.52 54.82 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.7 t -55.31 -23.68 24.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.099 0.476 . . . . 0.0 110.589 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.501 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 4.8 mm100 -107.83 -20.85 13.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.015 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.622 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 27.8 m-85 -96.08 -17.25 21.05 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.736 ' HG3' ' HB3' ' A' ' 26' ' ' PHE . 73.6 mttt -68.42 -29.83 68.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.829 0.347 . . . . 0.0 110.351 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.622 ' O ' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -102.32 26.71 7.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.057 0.456 . . . . 0.0 110.303 178.222 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.622 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 5.1 t -87.37 -42.87 15.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.464 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.516 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 10.6 tt0 -99.86 105.35 17.09 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.224 1.012 . . . . 0.0 111.075 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.866 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 112.718 -2.037 . . . . 0.0 110.618 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 57.4 t . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.661 0.267 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.61 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.21 -26.11 61.91 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.53 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.532 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.6 m -71.09 -18.94 62.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.873 0.844 . . . . 0.0 108.982 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.518 HD13 HG11 ' C' ' 92' ' ' VAL . 69.8 tp -76.98 -23.76 52.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.877 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.631 ' O ' HG13 ' B' ' 52' ' ' VAL . 1.7 mmt85 -67.99 -32.57 73.06 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.1 OUTLIER -70.84 -49.11 49.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.747 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.535 ' O ' ' HG ' ' B' ' 55' ' ' LEU . 39.7 tt0 -62.42 -31.69 72.43 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.631 HG13 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -77.56 -32.35 18.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.265 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 44.1 mt-10 -70.9 -27.67 63.96 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -68.35 -53.98 20.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.258 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 78.5 mt -57.87 -32.6 67.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.372 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.564 ' HB2' HD13 ' A' ' 15' ' ' LEU . 16.7 tt0 -70.41 -44.83 67.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.688 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.0 -31.12 75.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.476 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.74 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.5 OUTLIER -73.72 -46.56 45.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.729 0.3 . . . . 0.0 111.489 179.37 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.422 HG12 ' O ' ' B' ' 56' ' ' GLN . 13.2 p -70.21 -30.94 45.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.641 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -71.42 -40.86 70.18 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.528 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.0 p-80 -79.34 -19.11 51.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.656 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.74 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.9 mt -73.25 -39.72 65.2 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.588 ' HG3' HD23 ' A' ' 22' ' ' LEU . 37.7 tt0 -65.35 -42.18 93.1 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.1 -46.75 72.17 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.46 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.551 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.393 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.751 ' HB3' ' HG3' ' B' ' 70' ' ' LYS . 3.6 m-85 -58.49 -20.91 49.52 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 39.9 t -54.12 -25.61 23.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.054 0.454 . . . . 0.0 110.495 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.529 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 4.5 mm100 -106.51 -20.91 13.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.2 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.613 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 26.7 m-85 -95.75 -17.56 21.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.751 ' HG3' ' HB3' ' B' ' 66' ' ' PHE . 73.4 mttt -68.27 -30.24 69.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.076 0.465 . . . . 0.0 110.632 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.636 ' O ' HD22 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -101.88 26.61 7.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.298 0.571 . . . . 0.0 110.465 178.426 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.613 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 5.0 t -87.63 -42.44 15.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.645 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.501 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 12.4 tt0 -100.62 103.66 14.96 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 122.13 0.967 . . . . 0.0 111.339 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.857 ' N ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.499 0 CA-C-N 112.68 -2.055 . . . . 0.0 110.822 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 64.8 t . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.798 0.332 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.594 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.51 -26.05 62.51 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.001 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.547 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 67.2 m -71.82 -18.5 62.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.893 0.854 . . . . 0.0 108.849 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.543 HD13 HG11 ' A' ' 12' ' ' VAL . 65.6 tp -77.08 -23.25 51.93 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.634 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.658 ' O ' HG13 ' C' ' 92' ' ' VAL . 1.9 mmt85 -67.99 -32.51 72.96 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -71.29 -48.14 52.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.026 179.676 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.525 ' O ' ' HG ' ' C' ' 95' ' ' LEU . 38.7 tt0 -63.3 -31.77 73.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.583 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.658 HG13 ' O ' ' C' ' 89' ' ' ARG . 1.1 p -77.29 -32.7 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.263 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 43.9 mt-10 -70.95 -26.26 63.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.424 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -69.2 -53.79 18.14 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.173 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.553 HD13 ' HB2' ' A' ' 16' ' ' GLN . 75.5 mt -57.91 -32.77 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.423 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.527 ' HB2' HD23 ' B' ' 55' ' ' LEU . 16.9 tt0 -69.68 -44.84 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.623 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.469 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.61 -31.3 74.51 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.748 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.619 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 0.5 OUTLIER -74.72 -44.94 47.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.692 0.282 . . . . 0.0 111.509 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.431 HG12 ' O ' ' C' ' 96' ' ' GLN . 13.5 p -71.34 -30.51 40.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.453 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.469 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.2 pt20 -71.64 -42.2 67.89 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.157 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.619 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 10.5 p-80 -77.48 -19.03 56.54 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.902 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.675 HD13 ' HG3' ' A' ' 23' ' ' GLN . 1.5 mp -73.89 -39.45 63.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.558 ' HG3' HD23 ' B' ' 62' ' ' LEU . 38.2 tt0 -66.62 -41.46 88.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.03 71.72 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.421 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.552 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -63.33 -39.07 93.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.455 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.725 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 3.5 m-85 -58.58 -20.28 45.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.4 t -54.6 -25.67 27.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.212 0.529 . . . . 0.0 110.245 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.516 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 4.7 mm100 -105.54 -22.82 12.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.085 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.619 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 25.8 m-85 -93.75 -17.83 22.73 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.725 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 74.2 mttt -68.01 -28.54 67.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.021 0.439 . . . . 0.0 110.619 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.638 ' O ' HD22 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -104.05 26.52 8.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.223 0.535 . . . . 0.0 110.327 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.619 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 4.6 t -87.09 -42.66 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.214 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.529 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 7.4 tt0 -99.95 104.77 16.42 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 122.043 0.925 . . . . 0.0 111.342 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.816 ' N ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.465 0 CA-C-N 112.964 -1.926 . . . . 0.0 111.034 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.47 HG22 HG11 ' B' ' 45' ' ' VAL . 82.7 t . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -66.68 -37.52 84.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.785 0.326 . . . . 0.0 110.521 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.71 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 41.1 m -63.32 -26.35 68.72 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.834 0.826 . . . . 0.0 109.154 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.782 ' O ' HG22 ' A' ' 12' ' ' VAL . 62.5 tp -74.21 -39.87 62.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.255 178.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.654 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -55.86 -44.4 78.03 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.71 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -63.8 -42.15 97.76 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.757 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.509 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 36.7 tt0 -63.22 -34.8 78.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.989 0.423 . . . . 0.0 110.738 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.782 HG22 ' O ' ' A' ' 8' ' ' LEU . 54.5 t -70.07 -40.63 78.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.577 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 32.5 tt0 -63.3 -32.02 73.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -64.49 -61.42 2.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.549 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.443 HD13 ' HB2' ' B' ' 56' ' ' GLN . 2.7 mm? -60.27 -31.41 70.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.485 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.487 ' HB2' HD13 ' C' ' 95' ' ' LEU . 14.4 pt20 -74.16 -28.61 61.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -67.0 -33.55 84.16 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.703 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.9 mm100 -71.09 -50.5 33.1 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.334 -0.433 . . . . 0.0 111.102 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.8 -33.52 63.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.362 -0.535 . . . . 0.0 111.995 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -66.11 -43.17 87.99 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.96 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -76.97 -19.71 56.99 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.208 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.703 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 24.6 mt -71.01 -42.72 69.22 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.8 tm0? -70.19 -33.49 71.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.89 -62.46 1.73 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.48 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -42.61 98.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.863 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.667 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -57.0 -25.98 59.45 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.705 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -53.75 -28.59 35.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.267 0.556 . . . . 0.0 110.207 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.584 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 14.1 mt-30 -90.75 -50.29 5.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.893 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HA ' HG22 ' A' ' 32' ' ' VAL . 19.5 m-85 -66.58 -17.81 65.02 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -70.86 -20.71 62.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 110.782 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.25 35.52 3.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.592 0.71 . . . . 0.0 109.495 178.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.673 HG22 ' HA ' ' A' ' 29' ' ' TYR . 15.5 t -98.65 -35.64 5.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.805 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.53 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 40.3 tt0 -88.19 89.76 8.12 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 122.861 1.315 . . . . 0.0 110.934 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.995 0 CA-C-N 111.983 -2.371 . . . . 0.0 109.068 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.47 HG11 HG22 ' A' ' 5' ' ' VAL . 83.7 t . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.65 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.34 -38.38 87.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.664 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.0 m -63.8 -23.91 67.55 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.803 0.811 . . . . 0.0 109.548 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.791 ' O ' HG22 ' B' ' 52' ' ' VAL . 65.0 tp -76.04 -39.35 55.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.65 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -56.01 -44.2 78.45 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.664 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -64.21 -42.88 96.41 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.565 179.575 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.501 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 37.0 tt0 -62.04 -35.08 77.53 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.034 0.445 . . . . 0.0 110.787 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.791 HG22 ' O ' ' B' ' 48' ' ' LEU . 57.9 t -70.44 -40.11 77.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.607 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.502 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 32.9 tt0 -63.39 -32.05 73.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.8 0.809 . . . . 0.0 109.006 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -64.53 -61.19 2.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.588 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.427 HD13 ' HB2' ' C' ' 96' ' ' GLN . 2.6 mm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.353 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' B' ' 53' ' ' GLU . 14.1 pt20 -73.94 -28.78 61.68 Favored 'General case' 0 C--O 1.222 -0.395 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.556 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -67.25 -33.25 82.14 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 119.909 -1.138 . . . . 0.0 110.506 178.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.711 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.8 mm-40 -71.42 -49.66 39.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.547 -0.326 . . . . 0.0 111.263 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.56 -33.06 59.85 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.959 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -66.06 -44.36 84.78 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.899 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -76.01 -19.93 58.25 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.408 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 23.0 mt -71.28 -42.31 68.9 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 5.8 tm0? -69.98 -34.67 73.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.3 -61.94 2.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.459 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.16 -42.78 99.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.666 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.668 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -56.67 -26.15 55.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.195 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.9 t -54.1 -27.9 35.89 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.272 0.558 . . . . 0.0 110.325 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.582 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 14.3 mt-30 -90.87 -51.0 5.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.592 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.645 ' HA ' HG22 ' B' ' 72' ' ' VAL . 17.4 m-85 -65.72 -17.83 64.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -71.41 -20.64 62.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.979 0.419 . . . . 0.0 110.756 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.17 36.07 2.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.135 0.969 . . . . 0.0 109.181 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.645 HG22 ' HA ' ' B' ' 69' ' ' TYR . 15.6 t -99.56 -35.01 4.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.72 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.584 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 46.5 tt0 -88.85 89.12 7.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 122.869 1.319 . . . . 0.0 111.029 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.455 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.958 0 CA-C-N 111.713 -2.494 . . . . 0.0 109.256 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.45 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 89.5 t . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -66.81 -38.35 86.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.401 . . . . 0.0 110.166 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.692 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 20.9 m -62.78 -26.31 68.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.883 0.849 . . . . 0.0 109.287 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.428 ' O ' HG12 ' C' ' 92' ' ' VAL . 63.5 tp -73.09 -42.1 63.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.004 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.658 ' HB3' HH11 ' C' ' 89' ' ' ARG . 0.0 OUTLIER -55.82 -43.82 77.31 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.952 0.342 . . . . 0.0 110.637 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -63.48 -41.74 98.57 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.031 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.43 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 37.4 tt0 -63.0 -36.77 84.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.953 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.452 ' O ' HG23 ' C' ' 92' ' ' VAL . 0.2 OUTLIER -74.8 -31.29 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.398 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.581 -179.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' C' ' 96' ' ' GLN . 36.7 tt0 -65.34 -33.49 76.09 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -65.51 -58.85 4.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.657 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.487 HD13 ' HB2' ' A' ' 16' ' ' GLN . 3.3 mm? -60.97 -31.08 70.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.07 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' C' ' 93' ' ' GLU . 14.5 pt20 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.578 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -66.63 -34.11 86.51 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.157 -1.02 . . . . 0.0 110.619 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.5 mm-40 -70.62 -49.43 47.65 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.367 -0.416 . . . . 0.0 111.089 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . . . . . . . . . 7.7 p -68.08 -32.74 57.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 C-N-CA 120.342 -0.543 . . . . 0.0 112.194 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.86 -43.21 84.2 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.681 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -76.87 -19.69 57.17 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.013 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 23.6 mt -71.55 -41.95 68.45 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -70.69 -34.21 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.39 -62.4 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.472 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.49 96.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.664 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -56.27 -28.26 58.02 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.705 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.8 t -51.19 -29.93 15.49 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.133 0.492 . . . . 0.0 110.314 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.53 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 13.6 mt-30 -89.82 -51.33 5.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.047 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.672 ' HA ' HG22 ' C' ' 112' ' ' VAL . 19.3 m-85 -66.34 -17.27 64.67 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -177.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.47 -19.37 62.22 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.984 0.421 . . . . 0.0 110.875 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.08 35.7 3.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.812 0.815 . . . . 0.0 109.29 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.672 HG22 ' HA ' ' C' ' 109' ' ' TYR . 16.2 t -98.28 -36.08 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.835 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.582 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 43.1 tt0 -87.32 89.51 8.02 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.958 1.361 . . . . 0.0 111.039 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.933 0 CA-C-N 112.071 -2.331 . . . . 0.0 109.202 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.42 HG21 HG13 ' B' ' 45' ' ' VAL . 96.7 t . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.688 0.28 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.507 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.81 -33.46 75.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.112 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.4 m -66.95 -28.71 68.51 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.645 0.735 . . . . 0.0 109.792 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 70.0 tp -73.28 -22.34 60.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.09 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.676 ' HA ' HG21 ' A' ' 12' ' ' VAL . 25.8 mmm-85 -69.13 -23.59 63.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.698 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.3 OUTLIER -75.34 -40.2 58.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.432 ' O ' HD22 ' A' ' 15' ' ' LEU . 11.4 mm100 -72.07 -29.29 63.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.841 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.676 HG21 ' HA ' ' A' ' 9' ' ' ARG . 27.6 m -76.05 -38.71 35.6 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.296 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.58 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 95.7 mt-10 -70.06 -28.84 65.77 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.65 -60.85 2.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.015 177.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD11 ' HA ' ' A' ' 15' ' ' LEU . 2.0 mm? -58.3 -39.43 79.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.58 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 17.0 pt20 -67.13 -28.1 67.86 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.738 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.657 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -66.66 -33.42 84.36 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.714 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 82.3 mt-30 -72.05 -40.42 68.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.718 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 15' ' ' LEU . 2.6 t -67.65 -39.9 83.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.963 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.657 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.2 pt20 -62.18 -42.18 99.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.926 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.52 ' CE1' HD22 ' A' ' 22' ' ' LEU . 5.9 p-80 -81.66 -16.79 50.24 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.44 -0.904 . . . . 0.0 111.56 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -74.01 -43.6 57.43 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -68.07 -36.22 79.49 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.64 70.88 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.159 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.424 ' CB ' ' HE2' ' A' ' 29' ' ' TYR . . . -60.33 -43.91 95.99 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.581 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.612 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 1.8 m-85 -52.28 -30.17 26.68 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.489 0.493 . . . . 0.0 111.953 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.5 t -50.69 -31.92 17.81 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.984 0.421 . . . . 0.0 111.142 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.442 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 97.1 mm-40 -89.57 -44.62 9.96 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.715 ' HA ' HG22 ' A' ' 32' ' ' VAL . 41.8 m-85 -65.21 -20.02 66.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.867 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.3 -26.11 60.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.526 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.23 32.39 4.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.012 0.91 . . . . 0.0 109.453 178.013 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.715 HG22 ' HA ' ' A' ' 29' ' ' TYR . 65.7 t -128.13 -24.48 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.55 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.883 ' HG3' ' H ' ' A' ' 34' ' ' LEU . 3.5 pt-20 -65.18 -63.8 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.718 0.77 . . . . 0.0 112.361 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.883 ' H ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 113.53 -1.668 . . . . 0.0 115.107 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.42 HG13 HG21 ' A' ' 5' ' ' VAL . 96.4 t . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.773 0.321 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.482 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.1 -33.71 76.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.327 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.65 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.9 m -67.17 -28.07 67.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.688 0.756 . . . . 0.0 109.594 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 tp -73.15 -23.03 60.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.101 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.675 ' HA ' HG21 ' B' ' 52' ' ' VAL . 24.1 mmm-85 -69.07 -23.16 64.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.65 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.5 OUTLIER -74.99 -40.53 60.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.596 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.483 ' O ' HD22 ' B' ' 55' ' ' LEU . 11.5 mm100 -72.01 -29.12 63.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.872 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.675 HG21 ' HA ' ' B' ' 49' ' ' ARG . 27.2 m -76.4 -38.59 32.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.206 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.585 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 92.6 mt-10 -70.34 -28.06 64.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.79 -60.72 2.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.196 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.783 HD12 HG11 ' C' ' 99' ' ' VAL . 2.1 mm? -58.26 -39.59 79.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.005 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.585 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.7 pt20 -66.92 -28.45 68.31 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.398 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.655 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -66.15 -33.65 85.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.713 178.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.699 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 82.4 mt-30 -71.78 -40.37 69.3 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.497 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.4 HG22 ' O ' ' B' ' 55' ' ' LEU . 2.5 t -67.99 -39.84 82.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.064 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.3 pt20 -61.53 -42.48 98.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.83 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.534 ' CE1' HD22 ' B' ' 62' ' ' LEU . 5.9 p-80 -81.51 -17.77 47.42 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.447 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 6.5 mt -72.73 -43.7 62.64 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.445 ' HG2' HD21 ' A' ' 22' ' ' LEU . 4.9 tm0? -68.36 -36.54 79.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.99 -50.63 70.31 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.589 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.422 ' CB ' ' HE2' ' B' ' 69' ' ' TYR . . . -60.36 -43.83 96.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.394 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.567 ' HA ' ' HD2' ' B' ' 69' ' ' TYR . 1.5 m-85 -51.48 -30.67 20.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.692 0.62 . . . . 0.0 111.854 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 40.6 t -49.82 -33.47 16.81 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.837 0.351 . . . . 0.0 111.106 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.408 ' O ' ' HE2' ' B' ' 71' ' ' LYS . 97.4 mm-40 -88.68 -44.4 10.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.492 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.689 ' HA ' HG22 ' B' ' 72' ' ' VAL . 46.1 m-85 -64.86 -20.5 66.45 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.771 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -57.47 -27.21 62.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.234 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -105.01 31.97 4.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.083 0.944 . . . . 0.0 109.351 178.34 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.689 HG22 ' HA ' ' B' ' 69' ' ' TYR . 64.6 t -127.83 -24.8 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.257 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.876 ' HG3' ' H ' ' B' ' 74' ' ' LEU . 3.4 pt-20 -64.44 -64.53 0.86 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.663 0.744 . . . . 0.0 112.191 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.876 ' H ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.812 0 C-N-CA 125.987 1.715 . . . . 0.0 115.271 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.646 0.26 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.539 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.76 -33.05 75.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.73 0.3 . . . . 0.0 111.129 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.7 m -66.86 -29.05 68.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.652 0.739 . . . . 0.0 109.489 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.426 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 70.2 tp -72.7 -22.77 60.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.86 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 31.2 mmm-85 -66.32 -27.46 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.3 OUTLIER -73.02 -42.16 63.48 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.905 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.498 ' O ' HD22 ' C' ' 95' ' ' LEU . 11.6 mm100 -70.83 -27.37 63.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.662 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.426 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 0.8 OUTLIER -76.16 -42.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.314 -178.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.599 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 94.2 mt-10 -70.97 -27.16 63.53 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -63.76 -61.08 2.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.257 -1.338 . . . . 0.0 110.079 177.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.498 HD22 ' O ' ' C' ' 91' ' ' GLN . 1.6 mm? -58.09 -37.97 75.52 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.95 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.599 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 16.5 pt20 -69.13 -27.74 65.84 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.611 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.66 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -66.63 -33.44 84.47 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 178.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.448 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 83.5 mt-30 -72.52 -41.93 65.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.403 -0.399 . . . . 0.0 111.181 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.783 HG11 HD12 ' B' ' 55' ' ' LEU . 0.2 OUTLIER -72.38 -30.14 33.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.828 -179.399 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.66 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.0 pt20 -66.6 -43.33 85.15 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.106 -0.237 . . . . 0.0 110.503 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.448 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 8.3 p-80 -79.9 -16.67 54.88 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 119.939 -0.705 . . . . 0.0 111.433 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.612 ' HG ' ' CE2' ' A' ' 26' ' ' PHE . 1.3 mp -75.2 -42.39 55.72 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.09 -50.67 70.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.673 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.405 ' CB ' ' HE2' ' C' ' 109' ' ' TYR . . . -60.21 -43.88 95.59 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.357 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.554 ' HA ' ' HD2' ' C' ' 109' ' ' TYR . 1.6 m-85 -52.14 -30.42 26.46 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.942 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.9 t -49.94 -33.78 18.6 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.979 0.419 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.411 ' O ' ' HE2' ' C' ' 111' ' ' LYS . 97.1 mm-40 -87.46 -45.85 10.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.722 ' HA ' HG22 ' C' ' 112' ' ' VAL . 43.5 m-85 -64.28 -20.53 66.13 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.933 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -56.2 -28.0 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -105.23 32.07 4.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.947 0.879 . . . . 0.0 109.758 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.722 HG22 ' HA ' ' C' ' 109' ' ' TYR . 59.8 t -128.04 -23.96 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.2 -1.363 . . . . 0.0 110.479 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.823 ' HG3' ' H ' ' C' ' 114' ' ' LEU . 3.6 pt-20 -66.49 -60.44 2.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.875 0.845 . . . . 0.0 112.879 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.823 ' H ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.843 0 CA-C-N 113.859 -1.519 . . . . 0.0 115.04 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.453 -0.299 0 CA-C-O 120.787 0.327 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.511 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.44 -33.25 74.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.084 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.736 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 7.9 t -68.14 -20.8 64.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.585 ' O ' HG22 ' A' ' 12' ' ' VAL . 59.2 tp -76.2 -28.14 57.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.152 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 23.6 mmm-85 -62.91 -43.67 98.16 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.736 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.49 -37.09 82.33 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.566 178.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 84.7 mt-30 -63.33 -33.77 76.26 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 121.529 0.68 . . . . 0.0 109.469 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 8' ' ' LEU . 54.1 t -72.11 -35.08 52.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.469 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 97.7 mt-10 -66.35 -26.2 67.17 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.387 0.613 . . . . 0.0 109.545 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -69.43 -53.15 20.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.221 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.52 -35.31 67.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.489 ' O ' HG12 ' A' ' 19' ' ' VAL . 21.6 tt0 -71.3 -43.43 67.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.152 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.415 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -60.59 -31.83 76.22 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.871 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.574 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 58.9 mt-30 -75.27 -41.92 56.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.829 0.347 . . . . 0.0 111.167 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 16' ' ' GLN . 7.4 p -73.95 -27.4 22.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.59 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.415 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 17.8 pt20 -74.11 -40.01 62.97 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.571 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.574 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.3 p-80 -80.95 -19.9 43.17 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.602 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.695 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.8 mp -79.85 -33.99 39.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.642 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.696 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.4 tm0? -74.46 -30.2 61.77 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.3 -62.68 1.7 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.775 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -58.41 -43.29 88.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.371 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.592 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -53.86 -32.06 51.75 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.074 -179.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.5 t -50.51 -33.92 23.3 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.711 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.7 mt-30 -82.7 -46.78 12.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.236 0.541 . . . . 0.0 110.981 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.595 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 24.9 m-85 -71.29 -18.86 62.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.098 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 30' ' ' LYS . 14.2 tmtt? -72.91 -25.71 61.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.752 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.73 29.49 6.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.724 0.773 . . . . 0.0 109.347 177.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.595 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 8.8 t -95.27 -36.79 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.01 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.515 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 14.1 tt0 -95.2 101.05 12.77 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.744 1.259 . . . . 0.0 111.11 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.515 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.295 -1.781 0 CA-C-N 112.738 -2.028 . . . . 0.0 109.365 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.859 0.362 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.507 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.56 -33.1 74.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.748 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 8.2 t -68.81 -20.29 64.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.528 0.68 . . . . 0.0 109.277 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.606 ' O ' HG22 ' B' ' 52' ' ' VAL . 59.4 tp -76.0 -28.51 57.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.139 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 23.6 mmm-85 -62.88 -43.76 97.92 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.748 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -67.73 -36.59 80.86 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.649 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.534 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 86.1 mt-30 -63.46 -33.54 75.78 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.547 0.689 . . . . 0.0 109.325 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.606 HG22 ' O ' ' B' ' 48' ' ' LEU . 63.1 t -73.05 -34.68 46.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.128 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 96.7 mt-10 -66.17 -25.71 67.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.494 0.664 . . . . 0.0 109.241 178.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -70.06 -52.91 20.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.679 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.24 -34.82 68.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.265 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.46 ' O ' HG12 ' B' ' 59' ' ' VAL . 21.5 tt0 -71.48 -43.14 67.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.216 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -60.6 -32.37 78.1 Favored Glycine 0 C--N 1.319 -0.415 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.592 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.579 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 58.9 mt-30 -74.89 -41.63 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.824 0.345 . . . . 0.0 111.418 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.46 HG12 ' O ' ' B' ' 56' ' ' GLN . 8.1 p -74.14 -26.73 21.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.586 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.427 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 17.2 pt20 -74.46 -40.8 61.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.563 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.5 p-80 -80.16 -19.89 46.12 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.665 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.684 HD11 ' HG2' ' C' ' 103' ' ' GLN . 1.8 mp -79.51 -34.16 41.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.23 -0.588 . . . . 0.0 109.644 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD11 ' A' ' 22' ' ' LEU . 4.8 tm0? -74.34 -30.63 62.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.9 -63.17 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.025 -1.443 . . . . 0.0 109.751 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.486 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -57.24 -43.7 83.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.225 178.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.609 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -53.64 -32.64 52.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.012 -179.613 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.7 t -50.41 -32.58 18.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.855 0.36 . . . . 0.0 110.999 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.734 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 8.2 mt-30 -84.31 -46.65 11.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.171 0.51 . . . . 0.0 110.883 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.586 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 22.8 m-85 -70.88 -19.11 62.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.031 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.451 ' O ' ' HD3' ' B' ' 70' ' ' LYS . 14.0 tmtt? -73.04 -24.78 60.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.981 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.734 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -107.53 29.65 7.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.952 0.882 . . . . 0.0 109.45 176.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.586 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 8.1 t -95.24 -37.56 7.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.107 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.504 ' C ' ' HG ' ' B' ' 74' ' ' LEU . 14.2 tt0 -95.11 99.94 11.84 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 111.06 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.504 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.297 -1.692 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.826 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 86.2 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.819 0.342 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.526 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.53 -32.31 73.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.772 0.32 . . . . 0.0 111.497 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.733 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 7.9 t -69.27 -20.61 63.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.639 0.733 . . . . 0.0 109.209 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.603 ' O ' HG22 ' C' ' 92' ' ' VAL . 59.6 tp -75.78 -27.75 58.12 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.218 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 23.4 mmm-85 -63.37 -43.6 97.19 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.733 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.5 -35.59 77.72 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.46 179.067 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.537 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 85.4 mt-30 -64.07 -33.41 75.69 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 109.376 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.603 HG22 ' O ' ' C' ' 88' ' ' LEU . 54.8 t -72.54 -35.65 51.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.256 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 96.6 mt-10 -65.24 -27.54 68.73 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -68.34 -53.08 26.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.854 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -57.4 -34.84 69.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.294 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.473 ' O ' HG12 ' C' ' 99' ' ' VAL . 17.4 tt0 -71.12 -42.81 68.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.169 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.484 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.03 -31.67 77.46 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.86 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.606 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 57.9 mt-30 -75.41 -41.67 55.5 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.558 -0.378 . . . . 0.0 111.132 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.473 HG12 ' O ' ' C' ' 96' ' ' GLN . 7.6 p -73.96 -27.15 21.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.488 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.484 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 15.6 pt20 -74.12 -41.68 61.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 121.11 -0.236 . . . . 0.0 110.505 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.606 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.6 p-80 -79.29 -19.98 49.13 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.596 -0.842 . . . . 0.0 110.841 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.696 HD11 ' HG2' ' A' ' 23' ' ' GLN . 1.8 mp -79.37 -34.68 41.77 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.684 ' HG2' HD11 ' B' ' 62' ' ' LEU . 4.3 tm0? -73.81 -31.3 63.17 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 177.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.48 -63.06 1.41 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.678 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.474 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -57.82 -43.68 85.92 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.185 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -53.48 -32.34 49.72 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.384 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 45.9 t -50.91 -33.95 26.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.164 0.507 . . . . 0.0 110.815 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.71 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 8.3 mt-30 -81.99 -46.95 13.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.178 0.514 . . . . 0.0 110.908 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.595 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 26.4 m-85 -70.68 -18.93 62.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.138 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.435 ' HD3' ' O ' ' C' ' 110' ' ' LYS . 14.3 tmtt? -73.38 -24.92 60.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.905 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.71 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -107.21 28.12 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.791 0.805 . . . . 0.0 109.39 176.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.595 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 7.8 t -94.08 -36.9 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.08 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.481 ' HB2' HG22 ' B' ' 72' ' ' VAL . 9.0 tt0 -96.39 102.42 14.21 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.651 1.215 . . . . 0.0 110.808 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.292 -1.933 0 CA-C-N 112.548 -2.115 . . . . 0.0 110.022 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.474 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 58.5 t . . . . . 0 C--O 1.233 0.216 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.692 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.74 -30.4 71.5 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.641 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 44.4 t -63.96 -30.2 71.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.673 0.749 . . . . 0.0 109.293 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.63 HD21 HD21 ' C' ' 88' ' ' LEU . 59.2 tp -73.32 -25.73 60.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.692 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -69.03 -21.57 64.11 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.7 mt-30 -75.62 -40.53 56.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -69.23 -26.24 64.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.283 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.666 HG22 ' O ' ' A' ' 9' ' ' ARG . 15.2 m -78.21 -33.84 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.236 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 62.7 mm-40 -65.52 -34.4 78.16 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.89 6.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.952 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.416 HD11 HG11 ' B' ' 59' ' ' VAL . 41.8 tp -59.06 -39.34 81.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.742 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.539 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 18.0 pt20 -70.08 -23.28 63.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.649 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.561 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -68.72 -31.17 72.93 Favored Glycine 0 C--O 1.239 0.428 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.935 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.68 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.1 mm100 -73.27 -49.08 29.62 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.441 0.638 . . . . 0.0 110.629 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.573 ' HB ' HG21 ' B' ' 59' ' ' VAL . 7.7 p -70.02 -26.34 29.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 C-N-CA 120.226 -0.59 . . . . 0.0 112.027 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -71.66 -42.46 67.49 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.142 -0.349 . . . . 0.0 110.376 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.474 ' O ' ' HB1' ' A' ' 24' ' ' ALA . 6.0 p-80 -76.2 -18.13 59.21 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.613 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 18.6 mt -74.08 -39.86 63.14 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.571 ' HG2' HD23 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -69.4 -34.23 74.19 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.086 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -54.78 -63.62 1.09 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.289 177.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.47 85.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.681 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.544 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -55.16 -30.82 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.112 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -58.17 -31.52 67.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -88.56 -15.56 34.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.154 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.765 ' HA ' HG23 ' A' ' 32' ' ' VAL . 41.0 m-85 -99.96 -15.29 18.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.606 0.717 . . . . 0.0 110.543 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HG2' ' OH ' ' C' ' 109' ' ' TYR . 1.4 tmtp? -64.46 -33.22 75.38 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.793 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -101.38 23.77 10.56 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.253 0.549 . . . . 0.0 110.507 179.398 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.765 HG23 ' HA ' ' A' ' 29' ' ' TYR . 26.5 t -92.75 -26.27 4.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -64.35 -69.61 0.27 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.484 ' CD1' ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.47 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 59.8 t . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.717 0.294 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.724 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.45 -30.29 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.036 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.636 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 47.1 t -63.59 -30.55 71.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.638 0.733 . . . . 0.0 109.101 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.663 HD21 HD21 ' C' ' 88' ' ' LEU . 57.7 tp -73.84 -25.69 60.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.57 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.724 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -69.37 -20.29 63.83 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.636 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.8 mt-30 -77.03 -40.1 47.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -69.73 -26.61 64.41 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.985 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.664 HG22 ' O ' ' B' ' 49' ' ' ARG . 17.5 m -77.54 -34.32 20.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.302 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.551 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 62.9 mm-40 -65.12 -34.33 78.13 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.75 -59.34 5.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.865 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 tp -58.98 -39.11 80.76 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.551 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 17.4 pt20 -70.2 -23.36 62.93 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.623 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.564 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -69.36 -29.42 71.81 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.881 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.702 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.1 mm100 -74.35 -48.21 29.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.365 0.603 . . . . 0.0 110.784 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.573 HG21 ' HB ' ' A' ' 19' ' ' VAL . 6.9 p -70.75 -26.55 28.34 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.713 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.564 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -71.6 -41.99 68.27 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.361 178.409 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.497 ' O ' ' HB1' ' B' ' 64' ' ' ALA . 6.2 p-80 -76.33 -19.57 58.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.595 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 17.8 mt -72.1 -40.8 67.94 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.532 ' HG2' HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -69.23 -34.07 74.27 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.414 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -54.7 -63.14 1.25 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.254 178.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.87 85.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.579 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.521 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.86 -30.04 60.87 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.17 -179.33 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.6 t -59.6 -29.78 68.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.286 0.565 . . . . 0.0 110.79 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -89.07 -15.81 33.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.365 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.798 ' HA ' HG23 ' B' ' 72' ' ' VAL . 39.2 m-85 -100.66 -15.81 17.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.647 0.737 . . . . 0.0 110.454 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.5 -32.51 74.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.7 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -101.61 23.8 10.68 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.731 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.798 HG23 ' HA ' ' B' ' 69' ' ' TYR . 33.4 t -93.07 -26.54 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -64.3 -68.43 0.35 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.482 ' H ' ' CD1' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.467 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 62.2 t . . . . . 0 N--CA 1.453 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 110.987 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.732 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.65 -28.43 69.61 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.643 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 40.9 t -66.38 -29.66 69.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.596 0.712 . . . . 0.0 109.289 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.663 HD21 HD21 ' B' ' 48' ' ' LEU . 62.2 tp -73.66 -24.09 59.94 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.909 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.732 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -68.61 -23.32 64.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.2 mt-30 -75.87 -41.29 52.66 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.4 ' O ' ' HB1' ' C' ' 94' ' ' ALA . 75.2 mt-30 -69.09 -23.55 64.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.019 178.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.59 -40.81 28.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.277 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 55.4 mm-40 -64.55 -33.09 75.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.055 0.931 . . . . 0.0 108.56 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.4 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -61.72 -58.84 6.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.139 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.413 HD11 HG11 ' A' ' 19' ' ' VAL . 42.0 tp -59.52 -40.61 87.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.773 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' C' ' 99' ' ' VAL . 17.9 pt20 -68.02 -24.15 65.08 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.575 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.572 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -67.39 -30.95 75.81 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.096 -1.05 . . . . 0.0 110.949 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.673 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 9.6 mm100 -72.54 -46.51 54.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.801 0.334 . . . . 0.0 110.269 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -66.75 -34.69 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.53 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.85 -41.48 87.29 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.675 -177.589 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.501 ' O ' ' HB1' ' C' ' 104' ' ' ALA . 5.4 p-80 -77.64 -19.81 54.86 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.101 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.673 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 18.1 mt -73.45 -40.3 64.3 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.511 ' HG2' HD23 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -69.82 -34.17 73.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.328 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -54.76 -63.18 1.23 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.059 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -40.15 84.62 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.853 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.63 -31.43 62.3 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.091 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 33.7 t -57.58 -29.21 64.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.158 0.504 . . . . 0.0 110.632 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -90.81 -15.65 29.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.592 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.793 ' HA ' HG23 ' C' ' 112' ' ' VAL . 41.1 m-85 -100.78 -16.07 17.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.499 0.666 . . . . 0.0 110.642 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.404 ' HG2' ' OH ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -67.47 -26.73 66.52 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.972 -179.143 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER -104.38 22.43 14.89 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.176 177.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.793 HG23 ' HA ' ' C' ' 109' ' ' TYR . 37.2 t -92.13 -26.3 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -64.28 -68.05 0.38 Allowed 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.487 ' H ' ' CD1' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.651 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 -177.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.561 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 91.1 t . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.755 0.312 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.669 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.09 -32.43 73.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.841 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.694 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 34.5 m -71.4 -23.11 61.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.857 0.837 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.422 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 62.0 tp -77.89 -22.53 49.62 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.669 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -64.14 -44.13 93.13 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.056 178.227 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.694 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -70.39 -47.22 61.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.269 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 13.0 mm100 -61.64 -39.12 90.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.241 0.543 . . . . 0.0 110.838 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 2.6 t -73.2 -27.38 24.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.958 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.692 ' HA ' HE21 ' A' ' 16' ' ' GLN . 19.1 tt0 -67.31 -33.64 75.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.66 -60.83 2.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.632 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.546 HD13 ' HB2' ' B' ' 56' ' ' GLN . 3.4 mm? -57.32 -37.21 72.13 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.371 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.692 HE21 ' HA ' ' A' ' 13' ' ' GLU . 21.8 pt20 -72.16 -30.41 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.403 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -65.43 -30.32 77.31 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.738 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 76.4 mt-30 -70.56 -48.36 55.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.896 -0.652 . . . . 0.0 110.669 178.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.93 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 10.5 pt20 -59.79 -43.35 94.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.316 -178.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 5.1 p-80 -79.11 -14.55 59.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.544 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -75.66 -42.43 51.33 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.42 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.1 tm0? -68.77 -38.97 80.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.437 ' HB3' ' HA ' ' A' ' 21' ' ' HIS . . . -54.5 -48.05 72.32 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.484 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.31 -47.15 85.53 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.118 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -50.3 -25.77 4.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.426 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 47.7 t -49.64 -30.0 8.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.626 ' HG3' ' OE1' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -107.84 -11.62 15.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.528 ' CE2' ' HA ' ' B' ' 70' ' ' LYS . 55.0 m-85 -94.94 -21.87 18.35 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.771 -0.581 . . . . 0.0 109.696 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.548 ' HA ' ' CE2' ' C' ' 109' ' ' TYR . 22.7 pttp -59.64 -21.15 60.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.746 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -103.97 33.55 3.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.444 178.316 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 32' ' ' VAL . 71.1 t -124.91 -24.87 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.963 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.822 ' HG3' HD13 ' A' ' 34' ' ' LEU . 16.9 pt-20 -61.76 -40.77 96.29 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.822 HD13 ' HG3' ' A' ' 33' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.507 -0.679 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -176.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.581 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 99.1 t . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.673 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.7 -31.84 72.08 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.819 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.711 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 40.5 m -71.47 -23.78 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.678 0.751 . . . . 0.0 109.297 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.416 HD13 HG22 ' B' ' 52' ' ' VAL . 64.4 tp -77.57 -22.29 51.19 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.673 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 0.0 OUTLIER -63.94 -44.66 92.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.071 178.045 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.711 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.0 OUTLIER -69.93 -47.69 61.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 13.2 mm100 -61.3 -38.55 87.2 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.455 0.645 . . . . 0.0 110.912 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.416 HG22 HD13 ' B' ' 48' ' ' LEU . 2.6 t -74.03 -27.28 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.105 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.716 ' HA ' HE21 ' B' ' 56' ' ' GLN . 22.0 tt0 -67.3 -33.01 74.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -66.16 -59.83 3.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.835 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.517 HD13 ' HB2' ' C' ' 96' ' ' GLN . 3.4 mm? -58.55 -37.25 75.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.706 -1.134 . . . . 0.0 112.105 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.716 HE21 ' HA ' ' B' ' 53' ' ' GLU . 21.9 pt20 -71.83 -30.09 65.11 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.632 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.4 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -65.44 -31.82 81.51 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.776 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 76.4 mt-30 -69.85 -47.23 63.49 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.928 -0.636 . . . . 0.0 110.727 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.12 -44.62 99.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.693 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 11.0 pt20 -59.26 -42.44 91.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.6 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.439 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -80.31 -15.07 57.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.288 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.3 mt -74.82 -42.16 58.57 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.447 ' HG2' HD21 ' A' ' 22' ' ' LEU . 1.9 tm0? -69.12 -38.82 79.1 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.419 ' HB3' ' HA ' ' B' ' 61' ' ' HIS . . . -54.71 -48.94 71.85 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.202 177.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -60.95 -47.49 86.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.099 178.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -50.38 -26.15 4.65 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' SER . . . . . 0.453 ' O ' ' HE3' ' B' ' 70' ' ' LYS . 46.7 t -49.55 -30.11 8.0 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.626 ' HG3' ' OE1' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -108.25 -9.34 15.53 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.542 ' CE2' ' HA ' ' C' ' 110' ' ' LYS . 60.6 m-85 -97.27 -21.41 17.27 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.528 ' HA ' ' CE2' ' A' ' 29' ' ' TYR . 22.6 pttp -59.16 -22.05 60.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.668 -178.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -103.5 33.77 3.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.537 0.684 . . . . 0.0 110.584 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.432 HG12 ' O ' ' B' ' 72' ' ' VAL . 72.1 t -125.29 -24.27 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.835 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.843 ' HG3' HD13 ' B' ' 74' ' ' LEU . 17.1 pt-20 -61.8 -40.39 95.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.843 HD13 ' HG3' ' B' ' 73' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.589 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 93.2 t . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.692 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.14 -31.93 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.734 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 22.5 m -71.75 -23.87 61.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.811 0.815 . . . . 0.0 109.545 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.448 HD13 HG22 ' C' ' 92' ' ' VAL . 62.9 tp -77.42 -22.32 51.72 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.692 ' HB2' ' O ' ' C' ' 86' ' ' ALA . 0.0 OUTLIER -64.39 -43.24 95.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.252 178.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.1 pt20 -71.46 -47.35 56.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.196 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 11.8 mm100 -61.31 -39.07 89.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.217 0.532 . . . . 0.0 111.005 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.448 HG22 HD13 ' C' ' 88' ' ' LEU . 2.6 t -73.31 -27.81 24.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.068 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.74 ' HA ' HE21 ' C' ' 96' ' ' GLN . 22.9 tt0 -66.86 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -66.37 -59.98 3.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.902 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.535 HD13 ' HB2' ' A' ' 16' ' ' GLN . 3.6 mm? -58.48 -35.86 72.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.275 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.74 HE21 ' HA ' ' C' ' 93' ' ' GLU . 22.0 pt20 -73.58 -30.26 62.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.409 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.436 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.23 -29.52 75.07 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 177.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.758 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 76.3 mt-30 -72.27 -49.55 33.96 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.015 -0.593 . . . . 0.0 111.019 178.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.422 ' CG1' ' HA ' ' C' ' 96' ' ' GLN . 1.6 p -66.5 -34.61 71.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 10.4 pt20 -64.89 -43.97 91.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.554 -0.459 . . . . 0.0 111.104 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.423 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.8 p-80 -77.94 -15.13 59.24 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.83 -0.748 . . . . 0.0 111.037 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.758 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.1 mt -73.9 -41.62 61.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.484 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.2 tm0? -69.95 -37.97 76.0 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.14 74.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.379 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -61.25 -47.89 83.96 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.799 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -49.6 -26.18 3.39 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 107' ' ' SER . . . . . 0.475 ' O ' ' HE3' ' C' ' 110' ' ' LYS . 36.9 t -49.79 -30.52 9.79 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.619 ' HG3' ' OE1' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -106.87 -11.41 15.74 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' A' ' 30' ' ' LYS . 53.1 m-85 -94.94 -21.93 18.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.645 178.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.542 ' HA ' ' CE2' ' B' ' 69' ' ' TYR . 22.8 pttp -59.28 -21.19 59.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.003 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.09 33.52 3.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 110.325 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.461 ' O ' HG12 ' C' ' 112' ' ' VAL . 70.3 t -125.29 -25.92 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.59 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.626 ' OE1' ' HG3' ' B' ' 68' ' ' GLN . 16.6 pt-20 -59.7 -42.72 93.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.314 -0.954 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -176.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.401 HG23 HG11 ' B' ' 45' ' ' VAL . 69.5 t . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.742 0.306 . . . . 0.0 110.328 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.791 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -70.74 -20.79 62.6 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.74 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.672 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 32.1 t -67.88 -27.63 66.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 65.2 tp -74.34 -22.85 59.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.626 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.791 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 mmt85 -69.5 -22.1 63.63 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.5 mt-30 -73.75 -39.31 64.32 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.541 ' O ' HD22 ' A' ' 15' ' ' LEU . 9.8 mm100 -69.52 -33.17 72.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.577 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.768 HG22 ' HA ' ' A' ' 9' ' ' ARG . 29.0 m -74.53 -31.61 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.697 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.605 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.2 mt-10 -70.43 -29.73 66.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.48 -53.03 48.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.611 177.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.541 HD22 ' O ' ' A' ' 11' ' ' GLN . 3.9 mm? -57.71 -37.4 73.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.233 -1.349 . . . . 0.0 111.632 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.605 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 19.6 pt20 -76.48 -25.03 53.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.215 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.824 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -69.7 -37.52 76.63 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.801 -1.19 . . . . 0.0 110.701 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.69 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 65.4 mt-30 -72.88 -46.63 51.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.026 -0.587 . . . . 0.0 111.321 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.642 HG22 HD11 ' C' ' 102' ' ' LEU . 14.8 p -69.23 -32.83 55.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.693 -179.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.824 HE21 ' HA2' ' A' ' 17' ' ' GLY . 14.8 pt20 -67.55 -41.74 83.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.842 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.402 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.3 p-80 -78.61 -19.44 52.68 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.271 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -71.95 -43.73 64.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 tm0? -70.38 -33.34 71.29 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.35 -56.05 26.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.866 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.38 -41.38 98.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.132 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -26.06 59.02 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.519 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -53.43 -26.64 20.78 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.27 0.557 . . . . 0.0 110.34 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.418 HE21 ' HB3' ' A' ' 28' ' ' GLN . 4.1 mm100 -93.02 -53.66 4.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.589 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.577 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 21.7 m-85 -63.13 -20.15 65.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -67.09 -24.27 65.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.781 0.324 . . . . 0.0 110.756 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.526 ' O ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -109.84 34.21 3.97 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.748 0.785 . . . . 0.0 109.708 178.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.577 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 10.8 t -98.78 -33.6 4.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.942 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.66 88.57 7.16 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 122.707 1.241 . . . . 0.0 111.665 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.756 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.97 0 CA-C-N 112.438 -2.165 . . . . 0.0 110.296 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.401 HG11 HG23 ' A' ' 5' ' ' VAL . 79.1 t . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 120.924 0.392 . . . . 0.0 110.412 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.777 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -70.59 -20.62 62.75 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.658 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 19.3 t -68.42 -26.8 65.72 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 63.6 tp -74.32 -23.26 59.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.522 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.8 ' HA ' HG22 ' B' ' 52' ' ' VAL . 9.1 mmt85 -69.26 -22.08 63.86 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.658 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.3 mt-30 -74.4 -38.16 63.19 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.534 ' O ' HD22 ' B' ' 55' ' ' LEU . 10.1 mm100 -70.57 -32.94 70.54 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.391 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.8 HG22 ' HA ' ' B' ' 49' ' ' ARG . 28.0 m -74.73 -31.55 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.662 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.609 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 50.7 mt-10 -70.52 -30.03 66.69 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -65.25 -53.09 49.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.615 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.534 HD22 ' O ' ' B' ' 51' ' ' GLN . 3.9 mm? -57.46 -37.66 73.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.632 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.609 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 19.5 pt20 -76.4 -25.34 54.43 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.368 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.784 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -69.61 -37.43 77.46 Favored Glycine 0 C--O 1.242 0.6 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.663 178.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.686 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 69.3 mt-30 -72.53 -47.18 50.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.251 -0.475 . . . . 0.0 111.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.586 HG22 HD11 ' A' ' 22' ' ' LEU . 15.0 p -68.74 -32.57 55.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 C-N-CA 120.305 -0.558 . . . . 0.0 112.012 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.784 HE21 ' HA2' ' B' ' 57' ' ' GLY . 13.7 pt20 -68.23 -40.91 81.9 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.965 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.402 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.2 p-80 -79.18 -19.14 51.63 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.6 mt -72.33 -43.19 64.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -70.85 -33.75 70.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.92 -56.39 22.32 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.913 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.77 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.092 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.413 ' O ' ' HB3' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -57.46 -26.05 60.63 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.485 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t -53.67 -26.64 23.44 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.166 0.508 . . . . 0.0 110.459 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.405 HE21 ' HB3' ' B' ' 68' ' ' GLN . 4.8 mm100 -92.29 -54.84 3.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.459 178.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.606 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 21.6 m-85 -62.03 -20.12 63.61 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' B' ' 66' ' ' PHE . 0.0 OUTLIER -67.03 -23.46 65.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.849 -179.288 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.56 ' O ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -110.82 33.14 4.74 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.621 0.724 . . . . 0.0 109.678 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.606 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 16.2 t -97.1 -34.45 4.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.206 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -89.97 89.57 7.78 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 122.549 1.166 . . . . 0.0 111.414 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.732 HD23 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.292 -1.896 0 CA-C-N 112.486 -2.143 . . . . 0.0 110.393 178.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 69.1 t . . . . . 0 N--CA 1.452 -0.362 0 CA-C-O 120.789 0.328 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.797 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -70.5 -20.82 62.81 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 25.0 t -67.94 -27.35 66.54 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 65.8 tp -74.26 -22.8 59.16 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.761 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.803 ' HA ' HG22 ' C' ' 92' ' ' VAL . 9.0 mmt85 -69.59 -22.48 63.51 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.6 mt-30 -74.26 -37.21 63.82 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.539 ' O ' HD22 ' C' ' 95' ' ' LEU . 10.2 mm100 -71.63 -32.75 68.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.29 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.803 HG22 ' HA ' ' C' ' 89' ' ' ARG . 27.5 m -74.63 -31.83 27.97 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.609 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.584 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 49.5 mt-10 -69.72 -30.72 68.41 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -65.03 -52.98 52.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.777 -1.102 . . . . 0.0 109.706 177.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.539 HD22 ' O ' ' C' ' 91' ' ' GLN . 3.8 mm? -57.6 -37.69 73.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.696 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 19.5 pt20 -76.23 -25.15 54.76 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.318 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.793 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -69.69 -37.2 76.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 119.9 -1.143 . . . . 0.0 110.729 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.696 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 68.1 mt-30 -73.34 -46.26 50.28 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.419 . . . . 0.0 111.22 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.641 HG22 HD11 ' B' ' 62' ' ' LEU . 14.7 p -69.45 -32.47 53.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.667 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.793 HE21 ' HA2' ' C' ' 97' ' ' GLY . 15.4 pt20 -67.84 -42.17 81.83 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.866 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.421 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.1 p-80 -78.43 -18.88 54.31 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.454 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.696 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 14.3 mt -72.4 -43.59 63.69 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 177.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -70.12 -34.19 72.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.63 -55.86 28.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.24 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.8 98.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.829 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -57.57 -24.43 56.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.728 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 31.5 t -55.46 -26.46 42.4 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 110.391 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -92.78 -52.94 4.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.272 178.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.529 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 22.0 m-85 -63.18 -20.51 65.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.447 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 0.1 OUTLIER -66.49 -25.91 66.93 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.837 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.439 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -107.66 35.08 3.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.832 0.825 . . . . 0.0 109.949 178.783 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.529 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 12.6 t -99.42 -35.83 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.166 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.527 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 27.1 tt0 -88.92 90.46 8.42 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 122.681 1.229 . . . . 0.0 111.141 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.527 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.296 -1.746 0 CA-C-N 112.581 -2.1 . . . . 0.0 109.421 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 CA--C 1.52 -0.179 0 N-CA-C 110.861 -0.051 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.82 95.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.89 0.376 . . . . 0.0 111.416 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 23.4 m -63.7 -31.03 72.07 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 122.095 0.95 . . . . 0.0 110.353 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.939 HD22 ' HB3' ' B' ' 49' ' ' ARG . 37.0 tp -75.18 -54.54 6.95 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.81 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 1.036 ' HA ' HG23 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -58.26 -28.58 65.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 123.44 0.463 . . . . 0.0 112.067 -179.024 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.7 pt20 -70.63 -42.4 70.94 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -65.63 -10.3 34.64 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.948 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 1.036 HG23 ' HA ' ' A' ' 9' ' ' ARG . 15.7 t -78.57 -38.57 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-O 120.458 0.17 . . . . 0.0 110.769 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 21.9 pt-20 -73.26 -19.17 61.12 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.9 -49.63 23.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.513 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' B' ' 56' ' ' GLN . 10.4 tp -61.71 -33.58 74.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.351 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.401 ' O ' HG12 ' A' ' 19' ' ' VAL . 1.9 tp-100 -68.53 -42.32 78.65 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.581 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.644 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.77 -30.04 71.71 Favored Glycine 0 C--O 1.236 0.235 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.543 ' HA ' ' HD1' ' A' ' 21' ' ' HIS . 73.5 mt-30 -73.31 -47.4 42.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.263 0.554 . . . . 0.0 110.834 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.519 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.1 p -69.64 -26.41 30.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.337 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 1.7 pt20 -73.6 -39.58 64.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.543 ' HD1' ' HA ' ' A' ' 18' ' ' GLN . 9.7 p-80 -80.44 -12.29 59.58 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.02 -0.672 . . . . 0.0 109.783 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.565 HD13 ' CE2' ' B' ' 66' ' ' PHE . 0.1 OUTLIER -76.01 -39.21 56.24 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 176.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 69.8 mt-30 -70.74 -31.13 67.85 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.462 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -62.24 -44.17 97.17 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.642 177.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.18 -49.67 76.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.732 178.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.45 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 6.5 m-85 -54.96 -25.71 31.54 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.984 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -51.63 -31.8 26.66 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 110.748 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.409 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 76.0 mt-30 -88.55 -54.58 4.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.371 0.605 . . . . 0.0 110.502 178.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.4 m-85 -63.74 -19.46 64.97 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.554 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 21.0 ptmt -68.91 -30.29 68.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.611 0.243 . . . . 0.0 110.883 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.622 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -102.15 28.16 6.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.899 0.857 . . . . 0.0 109.813 178.394 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.642 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 24.4 t -94.03 -44.34 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.577 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.621 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 5.6 tt0 -111.6 109.76 19.82 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 122.276 1.036 . . . . 0.0 110.065 177.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.822 HD22 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.604 0 CA-C-N 113.013 -1.903 . . . . 0.0 109.434 -179.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.224 -0.239 0 N-CA-C 111.194 0.072 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -41.04 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 0.0 111.244 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' B' ' 50' ' ' GLN . 35.2 m -63.72 -31.38 72.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.259 1.028 . . . . 0.0 110.241 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.997 HD22 ' HB3' ' C' ' 89' ' ' ARG . 34.5 tp -75.07 -54.91 6.34 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.827 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 1.089 ' HA ' HG23 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -57.61 -28.96 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.465 0.478 . . . . 0.0 111.969 -178.818 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.598 ' O ' ' HG2' ' B' ' 53' ' ' GLU . 2.6 pt20 -70.43 -42.87 71.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.59 -10.58 36.73 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.629 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 1.089 HG23 ' HA ' ' B' ' 49' ' ' ARG . 16.2 t -78.18 -37.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.961 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' B' ' 50' ' ' GLN . 22.9 pt-20 -74.08 -18.69 60.78 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -48.52 27.46 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.184 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' C' ' 95' ' ' LEU . 10.8 tp -62.66 -32.86 73.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.428 ' HA ' HD13 ' A' ' 15' ' ' LEU . 1.9 tp-100 -69.42 -42.65 74.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.577 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.627 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.99 -30.26 69.66 Favored Glycine 0 CA--C 1.52 0.375 0 N-CA-C 111.124 -0.791 . . . . 0.0 111.124 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.548 ' HA ' ' HD1' ' B' ' 61' ' ' HIS . 73.3 mt-30 -72.62 -48.86 36.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.341 0.591 . . . . 0.0 111.046 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.502 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 2.4 p -69.14 -26.2 31.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.254 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 1.7 pt20 -73.59 -39.48 64.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.548 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 9.5 p-80 -80.63 -11.4 59.65 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.813 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.522 HD13 ' CE2' ' C' ' 106' ' ' PHE . 0.1 OUTLIER -76.46 -38.83 54.79 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 176.132 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' B' ' 59' ' ' VAL . 70.8 mt-30 -70.76 -31.27 68.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 177.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.428 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -62.15 -44.56 96.35 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.542 177.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.65 76.63 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.879 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.565 ' CE2' HD13 ' A' ' 22' ' ' LEU . 6.7 m-85 -55.56 -25.37 37.54 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.898 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.2 t -52.3 -31.13 31.52 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 118.045 0.384 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.416 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 76.8 mt-30 -88.56 -54.48 4.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.33 0.585 . . . . 0.0 110.621 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.648 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.9 m-85 -63.66 -20.05 65.39 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -177.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.552 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 21.1 ptmt -68.55 -30.5 69.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.645 0.26 . . . . 0.0 110.89 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.632 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.38 26.48 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.644 0.735 . . . . 0.0 110.068 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.648 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 25.0 t -92.47 -44.14 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.953 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.622 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 10.0 tt0 -112.28 109.93 19.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.32 1.057 . . . . 0.0 109.787 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.844 ' N ' HD22 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.628 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.161 -178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 66.4 t . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 110.863 -0.051 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' C' ' 90' ' ' GLN . . . -63.85 -43.31 96.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 110.97 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 40.6 m -62.47 -30.58 71.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.937 0.875 . . . . 0.0 110.649 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.957 HD22 ' HB3' ' A' ' 9' ' ' ARG . 32.8 tp -76.85 -53.53 7.78 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.778 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 1.087 ' HA ' HG23 ' C' ' 92' ' ' VAL . 0.0 OUTLIER -57.83 -29.52 65.01 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.528 0.518 . . . . 0.0 111.708 -179.033 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.598 ' O ' ' HG2' ' C' ' 93' ' ' GLU . 2.9 pt20 -69.72 -43.28 72.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 176.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 71.9 mt-30 -64.42 -11.82 37.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.915 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 1.087 HG23 ' HA ' ' C' ' 89' ' ' ARG . 17.2 t -77.36 -38.85 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 O-C-N 122.346 -0.221 . . . . 0.0 111.141 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' C' ' 90' ' ' GLN . 21.8 pt-20 -73.51 -17.21 61.24 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -74.86 -49.38 20.7 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.35 177.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.536 ' HB3' HD21 ' B' ' 55' ' ' LEU . 3.3 mt -59.76 -37.1 78.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.617 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.503 ' O ' HG22 ' C' ' 99' ' ' VAL . 2.0 tp-100 -66.07 -40.81 91.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.622 179.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.609 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -61.38 -30.28 73.81 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.558 ' HA ' ' HD1' ' C' ' 101' ' ' HIS . 73.4 mt-30 -73.59 -47.86 37.14 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.751 -0.264 . . . . 0.0 110.578 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.503 HG22 ' O ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -65.9 -32.31 57.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.389 179.334 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 1.7 pt20 -68.36 -39.73 81.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -178.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.558 ' HD1' ' HA ' ' C' ' 98' ' ' GLN . 13.0 p-80 -81.43 -10.54 59.49 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.795 178.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.486 ' CD2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -81.4 -33.5 32.19 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' C' ' 99' ' ' VAL . 71.5 mt-30 -74.45 -29.52 61.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 175.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.446 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -62.99 -44.91 94.72 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.478 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -49.99 75.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.688 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.522 ' CE2' HD13 ' B' ' 62' ' ' LEU . 6.5 m-85 -55.04 -25.73 32.56 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.092 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.6 t -51.69 -30.47 22.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.105 0.411 . . . . 0.0 110.594 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.426 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 77.0 mt-30 -89.66 -54.6 3.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.556 0.693 . . . . 0.0 110.678 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.641 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -63.46 -20.2 65.38 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.985 -1.007 . . . . 0.0 113.56 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 21.3 ptmt -68.37 -30.03 68.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 111.154 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.621 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.99 27.04 6.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.693 0.759 . . . . 0.0 109.924 178.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.641 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 24.9 t -92.94 -44.22 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.903 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.632 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 6.2 tt0 -112.31 109.54 19.24 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.164 0.983 . . . . 0.0 109.838 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.812 ' N ' HD22 ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.653 0 CA-C-N 113.033 -1.894 . . . . 0.0 108.977 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 120.803 0.335 . . . . 0.0 110.437 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.78 -37.38 86.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.894 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.744 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -65.96 -22.9 66.5 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.585 0.707 . . . . 0.0 109.899 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.739 ' O ' HG22 ' A' ' 12' ' ' VAL . 52.7 tp -75.91 -30.57 58.8 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.231 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.506 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mmm-85 -62.88 -39.62 95.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.744 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.48 -37.21 79.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.59 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.48 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 82.7 mt-30 -64.24 -30.0 71.07 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.213 0.53 . . . . 0.0 109.868 178.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.739 HG22 ' O ' ' A' ' 8' ' ' LEU . 83.4 t -72.68 -40.27 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HA ' HE21 ' A' ' 16' ' ' GLN . 13.8 tp10 -63.25 -33.99 76.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 122.159 0.981 . . . . 0.0 108.779 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 11' ' ' GLN . . . -64.01 -61.29 2.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.087 -1.415 . . . . 0.0 111.268 178.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.479 HD22 HG11 ' B' ' 59' ' ' VAL . 2.6 tm? -59.51 -38.87 82.08 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.416 -1.266 . . . . 0.0 111.662 -178.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.495 HE21 ' HA ' ' A' ' 13' ' ' GLU . 22.5 pt20 -70.77 -23.32 62.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.436 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.651 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.36 -27.55 73.54 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.035 -1.078 . . . . 0.0 110.44 177.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.712 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 80.1 mm-40 -75.04 -48.12 25.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.086 0.47 . . . . 0.0 110.71 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.478 HG11 HD22 ' C' ' 95' ' ' LEU . 2.4 p -67.97 -33.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.817 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.651 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 11.2 pt20 -66.32 -43.92 84.85 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.877 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.496 ' N ' ' HG3' ' A' ' 20' ' ' GLN . 7.8 p-80 -76.34 -16.08 59.83 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.747 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.712 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.9 mt -73.3 -36.93 66.36 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.694 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.8 tm0? -70.99 -33.98 70.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -58.41 -51.91 67.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.704 177.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.58 -38.6 90.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.507 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.434 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -55.7 -30.03 60.41 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.369 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 t -49.22 -27.3 3.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.993 0.425 . . . . 0.0 111.13 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -96.04 -45.61 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.539 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 22.4 m-85 -68.42 -21.51 64.66 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.464 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 45.9 mtpt -71.21 -28.68 64.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.721 0.295 . . . . 0.0 111.159 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.454 ' O ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -100.17 30.31 3.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.665 0.745 . . . . 0.0 109.677 178.592 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.539 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 13.0 t -95.66 -42.56 12.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.952 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.528 ' HB2' HG22 ' C' ' 112' ' ' VAL . 18.9 tt0 -103.44 101.87 11.77 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.086 0.946 . . . . 0.0 111.034 178.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.81 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.683 0 CA-C-N 112.905 -1.952 . . . . 0.0 110.291 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.739 0.304 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -65.72 -37.55 86.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.195 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.728 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 51.1 m -66.25 -22.29 66.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.641 0.734 . . . . 0.0 109.76 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.731 ' O ' HG22 ' B' ' 52' ' ' VAL . 50.6 tp -75.93 -31.12 58.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.321 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.497 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 16.7 mmm-85 -62.75 -39.74 95.08 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.728 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -68.0 -37.72 81.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.717 178.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.497 ' O ' ' HB1' ' B' ' 54' ' ' ALA . 82.3 mt-30 -63.99 -30.21 71.3 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.459 0.647 . . . . 0.0 109.889 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.731 HG22 ' O ' ' B' ' 48' ' ' LEU . 77.6 t -71.72 -41.48 70.71 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.046 179.211 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.519 ' HA ' HE21 ' B' ' 56' ' ' GLN . 15.1 tp10 -62.04 -33.57 74.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.218 1.009 . . . . 0.0 108.93 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' B' ' 51' ' ' GLN . . . -64.71 -60.67 2.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.465 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.99 -38.87 83.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.568 -1.197 . . . . 0.0 111.571 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.519 HE21 ' HA ' ' B' ' 53' ' ' GLU . 22.3 pt20 -70.27 -24.41 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.384 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.645 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -66.99 -26.7 73.27 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 119.924 -1.131 . . . . 0.0 110.441 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.706 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 80.9 mm-40 -75.86 -48.6 20.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.317 0.58 . . . . 0.0 110.72 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.479 HG11 HD22 ' A' ' 15' ' ' LEU . 2.4 p -67.93 -31.69 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.687 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.645 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.7 pt20 -67.74 -43.67 79.38 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.785 178.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.521 ' N ' ' HG3' ' B' ' 60' ' ' GLN . 7.7 p-80 -76.47 -14.92 60.01 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 119.51 -0.876 . . . . 0.0 110.657 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.729 HD21 ' HG2' ' C' ' 103' ' ' GLN . 14.6 mt -74.57 -37.9 62.83 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 176.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.71 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.1 tm0? -70.29 -33.8 71.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 177.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -58.46 -51.0 71.71 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.787 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -38.84 92.51 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.572 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.428 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.3 OUTLIER -56.07 -29.55 60.69 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.269 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -50.07 -26.37 4.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.082 0.468 . . . . 0.0 110.841 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -96.34 -46.29 6.46 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.621 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.549 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 21.6 m-85 -68.54 -21.14 64.57 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.446 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 48.0 mtpt -71.63 -27.3 63.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.744 0.307 . . . . 0.0 110.982 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.464 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.66 30.9 4.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.724 0.773 . . . . 0.0 109.649 178.209 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.549 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 12.6 t -96.24 -42.94 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.794 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.47 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 20.3 tt0 -103.32 101.74 11.68 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.13 0.967 . . . . 0.0 111.252 178.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.781 HD23 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-N 112.863 -1.971 . . . . 0.0 110.257 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 98.6 t . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.737 0.303 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.431 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.73 -37.1 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.94 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.755 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 49.1 m -66.82 -23.18 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.476 0.655 . . . . 0.0 109.653 178.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.477 ' O ' HG12 ' C' ' 92' ' ' VAL . 49.3 tp -73.96 -32.06 63.3 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.851 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.467 ' HA ' ' CG1' ' C' ' 92' ' ' VAL . 13.3 mmm-85 -63.27 -37.97 89.33 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.755 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.56 -36.74 79.18 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' C' ' 87' ' ' SER . 81.8 mt-30 -64.13 -33.14 75.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.128 177.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.477 HG12 ' O ' ' C' ' 88' ' ' LEU . 0.5 OUTLIER -75.11 -31.89 25.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.942 179.576 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.513 ' HA ' HE21 ' C' ' 96' ' ' GLN . 15.8 tp10 -64.64 -36.33 83.91 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -63.35 -59.75 4.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.522 -1.217 . . . . 0.0 111.322 178.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.478 HD22 HG11 ' A' ' 19' ' ' VAL . 2.5 tm? -58.93 -40.21 83.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.551 -178.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.679 ' HA ' HG22 ' C' ' 99' ' ' VAL . 20.8 pt20 -69.35 -24.3 63.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.483 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.692 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -66.13 -28.18 73.49 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.356 -1.097 . . . . 0.0 110.356 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.704 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 78.8 mm-40 -74.43 -46.27 41.06 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.414 178.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.679 HG22 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.01 -41.69 93.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.421 -0.511 . . . . 0.0 111.169 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.692 HE21 ' HA2' ' C' ' 97' ' ' GLY . 14.5 pt20 -61.87 -43.15 99.43 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.031 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.545 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.2 p-80 -78.55 -14.85 59.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.774 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.3 mt -74.21 -37.91 63.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.2 tm0? -71.08 -34.19 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.411 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -58.13 -51.51 69.42 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.396 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -38.14 90.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.804 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.553 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 1.0 OUTLIER -56.32 -29.67 61.59 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 123.451 0.469 . . . . 0.0 111.016 178.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 29.6 t -48.37 -26.94 2.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.107 0.48 . . . . 0.0 111.024 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.402 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 13.7 mm100 -96.98 -46.5 6.18 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.909 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.54 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 21.5 m-85 -68.48 -20.57 64.61 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.553 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 44.3 mtpt -72.11 -28.1 63.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.48 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -101.33 31.51 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.832 0.825 . . . . 0.0 109.84 178.157 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.54 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -96.49 -42.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.956 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.52 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 20.6 tt0 -103.04 100.85 10.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.287 1.042 . . . . 0.0 111.306 178.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.52 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 112.794 -2.003 . . . . 0.0 109.847 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.907 0.384 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.431 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -68.41 -29.29 67.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.752 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.598 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 49.2 m -70.02 -22.51 63.09 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.949 0.88 . . . . 0.0 109.391 178.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.2 tp -76.8 -21.72 54.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.513 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.581 ' HA ' HG12 ' A' ' 12' ' ' VAL . 7.9 mmm180 -67.56 -33.9 75.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -71.7 -47.12 56.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 179.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.416 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 7.6 tt0 -64.53 -27.75 69.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.281 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.581 HG12 ' HA ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -77.64 -36.92 23.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.766 -178.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.528 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.7 mt-10 -69.99 -28.6 65.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.29 -50.93 63.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.341 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' B' ' 56' ' ' GLN . 28.0 tp -60.79 -39.13 87.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.124 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.548 ' HA ' HG23 ' A' ' 19' ' ' VAL . 16.1 pt20 -71.42 -23.45 61.86 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.325 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.592 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.34 -28.36 73.31 Favored Glycine 0 C--O 1.24 0.521 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.441 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.664 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.3 mm-40 -73.65 -42.77 60.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.98 0.419 . . . . 0.0 110.005 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.548 HG23 ' HA ' ' A' ' 16' ' ' GLN . 3.4 t -65.94 -42.58 92.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.159 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.6 pt20 -62.33 -41.44 98.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.539 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.496 ' HA ' ' HB1' ' A' ' 24' ' ' ALA . 6.9 p-80 -79.26 -17.38 54.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.806 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 63' ' ' GLN . 7.3 mt -71.95 -47.57 51.38 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.729 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 13.2 pt20 -71.36 -22.7 61.86 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.496 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -62.21 -51.3 68.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.64 99.63 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.548 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.729 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -52.03 -29.13 19.73 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.692 178.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.4 t -47.67 -33.47 6.89 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.008 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.848 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 69.6 mt-30 -86.73 -51.51 6.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.457 0.646 . . . . 0.0 110.884 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.634 ' HA ' HG23 ' A' ' 32' ' ' VAL . 15.3 m-85 -63.94 -21.31 66.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.29 -0.868 . . . . 0.0 113.167 -177.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD2' ' CE2' ' C' ' 109' ' ' TYR . 10.4 mmmm -64.63 -32.2 73.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.963 0.411 . . . . 0.0 110.51 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.848 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -108.52 35.91 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.095 0.474 . . . . 0.0 110.763 179.394 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.634 HG23 ' HA ' ' A' ' 29' ' ' TYR . 5.9 t -95.66 -43.59 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.575 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.52 102.35 11.98 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 122.084 0.945 . . . . 0.0 110.551 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.794 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.462 0 CA-C-N 113.041 -1.89 . . . . 0.0 111.288 -179.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 60.8 t . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.778 0.323 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.447 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.53 -29.35 68.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.788 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.626 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.6 m -69.28 -23.97 63.9 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.715 0.769 . . . . 0.0 109.461 178.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.5 tp -76.0 -21.96 56.34 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.642 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.601 ' HA ' HG12 ' B' ' 52' ' ' VAL . 8.2 mmm180 -67.07 -33.96 76.64 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -71.68 -47.0 57.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.861 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 7.7 tt0 -64.56 -28.11 69.41 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.062 179.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.601 HG12 ' HA ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -76.95 -36.82 25.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.953 -178.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.549 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 47.8 mt-10 -70.57 -28.1 64.64 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 122.017 0.913 . . . . 0.0 108.551 176.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -65.22 -51.58 60.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.07 177.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.491 HD11 HG12 ' C' ' 99' ' ' VAL . 25.9 tp -60.19 -40.13 88.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.25 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.9 pt20 -70.68 -23.29 62.46 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.438 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.578 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.43 -29.1 72.96 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.657 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.5 mm100 -73.01 -42.44 63.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.112 0.482 . . . . 0.0 110.062 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.528 HG23 ' HA ' ' B' ' 56' ' ' GLN . 3.5 t -66.62 -42.11 89.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.344 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.578 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.2 pt20 -62.41 -41.85 98.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.07 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.486 ' O ' ' HB1' ' B' ' 64' ' ' ALA . 6.7 p-80 -78.76 -17.23 56.13 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.137 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.692 HD22 ' HB3' ' C' ' 103' ' ' GLN . 7.5 mt -72.98 -46.5 51.93 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.754 ' HA ' ' HB2' ' B' ' 66' ' ' PHE . 12.7 pt20 -71.76 -22.14 61.64 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -62.42 -51.44 67.51 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.68 98.9 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.498 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.754 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -51.94 -29.28 19.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.517 179.058 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 41.8 t -47.89 -34.71 9.3 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.862 0.363 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.843 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 66.9 mt-30 -85.45 -50.54 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.2 0.524 . . . . 0.0 110.841 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.665 ' HA ' HG23 ' B' ' 72' ' ' VAL . 15.9 m-85 -64.89 -20.62 66.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.431 ' HD2' ' CE2' ' A' ' 29' ' ' TYR . 10.2 mmmm -65.05 -32.24 73.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.117 0.484 . . . . 0.0 110.419 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.843 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -108.07 36.74 2.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.6 0.714 . . . . 0.0 110.637 179.08 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.665 HG23 ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -96.51 -43.2 12.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.549 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -105.11 100.83 10.41 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.031 0.92 . . . . 0.0 110.866 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.775 ' N ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.474 0 CA-C-N 113.404 -1.726 . . . . 0.0 111.29 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 73.7 t . . . . . 0 CA--C 1.528 0.132 0 CA-C-O 120.754 0.311 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.42 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.18 -29.84 68.81 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.832 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.621 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.1 m -69.19 -22.76 63.88 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.874 0.845 . . . . 0.0 109.22 178.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.586 ' O ' HG22 ' C' ' 92' ' ' VAL . 67.1 tp -76.15 -23.02 54.78 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.713 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.539 ' HA ' ' CG2' ' C' ' 92' ' ' VAL . 8.5 mmm180 -67.51 -31.88 72.31 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.664 0.745 . . . . 0.0 109.032 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.621 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -72.51 -45.2 60.51 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.482 -0.781 . . . . 0.0 108.949 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 7.8 tt0 -65.07 -29.31 70.18 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.257 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.586 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.14 -42.18 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.91 179.181 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.515 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.1 mt-10 -65.0 -29.52 70.45 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -65.13 -52.89 52.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.408 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 16' ' ' GLN . 28.4 tp -60.22 -39.93 88.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.325 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.561 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 18.1 pt20 -71.92 -22.29 61.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.408 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.596 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -69.59 -27.83 72.95 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.637 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 11.2 mm100 -74.63 -44.62 49.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.162 0.506 . . . . 0.0 110.413 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.561 ' CG1' ' HA ' ' C' ' 96' ' ' GLN . 0.1 OUTLIER -70.74 -31.96 47.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.124 -179.077 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.596 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.8 pt20 -67.04 -42.45 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.707 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.488 ' O ' ' HB1' ' C' ' 104' ' ' ALA . 7.6 p-80 -77.45 -17.53 58.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.234 -0.986 . . . . 0.0 110.592 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.722 HD22 ' HB3' ' A' ' 23' ' ' GLN . 8.4 mt -71.81 -47.06 55.9 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.712 ' HA ' ' HB2' ' C' ' 106' ' ' PHE . 14.3 pt20 -70.99 -22.75 62.14 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.488 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -61.68 -51.99 66.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.64 98.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.712 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -51.77 -29.32 18.42 Favored 'General case' 0 C--O 1.214 -0.781 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.411 178.874 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 46.4 t -47.75 -34.67 8.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.831 0.348 . . . . 0.0 111.124 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.838 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 69.4 mt-30 -85.23 -50.99 6.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.51 0.672 . . . . 0.0 110.665 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.694 ' HA ' HG23 ' C' ' 112' ' ' VAL . 16.1 m-85 -64.5 -21.58 66.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.136 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.474 ' HD2' ' CE2' ' B' ' 69' ' ' TYR . 10.4 mmmm -65.16 -30.25 71.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.442 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.838 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -109.75 36.94 2.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.523 0.678 . . . . 0.0 110.446 179.204 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.694 HG23 ' HA ' ' C' ' 109' ' ' TYR . 5.8 t -97.22 -43.72 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.663 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.49 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 35.8 tt0 -104.73 100.66 10.3 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.252 1.025 . . . . 0.0 110.725 179.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.544 HD21 ' HA ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.304 -1.382 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.491 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.444 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 74.4 t . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.637 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -71.22 -24.81 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.122 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -73.49 -18.58 61.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.67 0.748 . . . . 0.0 109.618 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.48 HD22 HD22 ' B' ' 48' ' ' LEU . 60.0 tp -79.03 -18.81 52.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.637 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -70.79 -44.33 66.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.219 177.856 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.2 pt20 -70.8 -33.91 71.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.007 0.432 . . . . 0.0 109.946 178.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.9 tt0 -69.86 -31.22 68.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.457 0.646 . . . . 0.0 110.391 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.453 HG11 ' N ' ' A' ' 13' ' ' GLU . 1.4 p -79.3 -31.47 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.154 -179.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 46.3 mt-10 -76.06 -20.47 57.72 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.06 -51.62 30.51 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.284 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' B' ' 56' ' ' GLN . 25.0 tp -63.16 -30.48 71.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.972 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -64.4 -40.49 95.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.53 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.644 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -63.44 -27.39 70.75 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.424 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.643 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.6 mm100 -71.51 -42.34 68.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.947 0.403 . . . . 0.0 110.047 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.513 HG12 ' HB3' ' C' ' 98' ' ' GLN . 2.4 t -70.88 -37.61 69.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.775 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.644 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 15.3 pt20 -64.37 -40.99 96.93 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.818 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.53 ' O ' ' HB2' ' A' ' 24' ' ' ALA . 7.7 p-80 -80.12 -17.48 52.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.316 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.0 mt -71.43 -38.44 71.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.47 ' HG2' HD23 ' C' ' 102' ' ' LEU . 66.6 mt-30 -73.78 -27.5 61.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.53 ' HB2' ' O ' ' A' ' 21' ' ' HIS . . . -59.7 -56.79 17.42 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.099 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.33 -43.89 97.76 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.142 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.436 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -53.42 -26.09 18.47 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.975 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -53.98 -36.89 63.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 111.446 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 24.7 pt20 -87.45 -36.48 17.67 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.103 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.743 ' OH ' ' HD2' ' B' ' 70' ' ' LYS . 26.5 m-85 -73.66 -20.41 60.57 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.439 0.638 . . . . 0.0 110.906 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.691 ' HD2' ' OH ' ' C' ' 109' ' ' TYR . 35.2 tptt -64.56 -40.32 95.35 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.172 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.615 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -95.38 31.48 1.96 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.684 0.754 . . . . 0.0 110.524 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.532 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 9.4 t -95.45 -41.27 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.062 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.541 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 16.8 tt0 -102.62 103.45 13.74 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 122.177 0.989 . . . . 0.0 110.464 178.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.795 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.632 0 CA-C-N 112.942 -1.935 . . . . 0.0 110.292 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.466 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 82.2 t . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.64 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -71.29 -23.92 62.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.025 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.622 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.9 m -74.52 -18.56 60.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.6 0.714 . . . . 0.0 109.74 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 8' ' ' LEU . 61.3 tp -79.36 -18.27 52.79 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.64 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 0.2 OUTLIER -70.75 -44.27 67.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.212 177.773 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.622 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.4 pt20 -70.91 -34.84 71.95 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.444 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 40.1 tt0 -68.88 -30.79 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.565 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 49' ' ' ARG . 1.5 p -79.67 -32.23 14.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.233 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 46.1 mt-10 -75.54 -20.17 58.86 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.13 -51.88 27.96 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.156 177.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' C' ' 96' ' ' GLN . 23.0 tp -63.09 -30.29 71.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.989 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.457 ' HA ' HD13 ' A' ' 15' ' ' LEU . 11.7 tt0 -64.0 -39.83 94.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.572 177.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.635 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -64.39 -26.89 71.0 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.733 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.65 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.2 mm100 -72.03 -42.7 66.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.062 0.458 . . . . 0.0 110.0 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.532 HG12 ' HB3' ' A' ' 18' ' ' GLN . 2.4 t -69.97 -37.96 74.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.782 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.635 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -64.53 -41.76 96.17 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.013 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' B' ' 64' ' ' ALA . 7.9 p-80 -78.9 -17.32 55.74 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.328 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.0 mt -71.88 -38.43 70.02 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.479 ' HG2' HD23 ' A' ' 22' ' ' LEU . 63.9 mt-30 -73.98 -26.51 60.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' B' ' 61' ' ' HIS . . . -61.07 -55.96 26.5 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.09 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -62.82 -44.98 94.72 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.042 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -52.46 -25.94 11.46 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.893 179.211 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 28.2 t -54.61 -35.62 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.748 0.249 . . . . 0.0 111.44 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' B' ' 65' ' ' ALA . 24.0 pt20 -88.74 -36.4 16.15 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.039 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.742 ' OH ' ' HD2' ' C' ' 110' ' ' LYS . 27.0 m-85 -73.79 -19.96 60.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.304 0.573 . . . . 0.0 110.761 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.743 ' HD2' ' OH ' ' A' ' 29' ' ' TYR . 32.8 tptt -64.55 -41.23 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.933 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.598 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -94.53 31.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.433 0.635 . . . . 0.0 110.775 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.536 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 9.3 t -95.17 -41.68 12.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.931 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.615 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 15.1 tt0 -102.46 103.41 13.79 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 122.24 1.019 . . . . 0.0 110.658 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.753 HD23 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.615 0 CA-C-N 112.811 -1.995 . . . . 0.0 110.114 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.474 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 84.9 t . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.616 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -71.84 -24.01 61.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.265 178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 71.1 m -74.9 -18.57 60.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.743 0.783 . . . . 0.0 109.25 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.501 ' O ' HG22 ' C' ' 92' ' ' VAL . 57.0 tp -77.63 -19.3 55.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.732 ' O ' HG21 ' C' ' 92' ' ' VAL . 0.2 OUTLIER -71.32 -42.71 68.24 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.649 178.272 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 pt20 -70.95 -33.52 70.55 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 38.8 tt0 -68.82 -33.49 73.92 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.238 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.732 HG21 ' O ' ' C' ' 89' ' ' ARG . 0.0 OUTLIER -73.82 -38.52 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.913 178.243 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.537 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 42.0 mt-10 -68.49 -21.56 64.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.96 -52.54 23.55 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.208 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.66 -33.52 72.94 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.944 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.419 ' HA ' HD13 ' B' ' 55' ' ' LEU . 12.8 tt0 -62.66 -40.38 96.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.541 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -64.87 -27.19 71.81 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.481 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.646 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.2 mm100 -71.58 -42.77 67.38 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 178.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.507 HG12 ' HB3' ' B' ' 58' ' ' GLN . 2.5 t -70.73 -37.17 67.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.541 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.3 pt20 -65.25 -40.74 94.39 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.616 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.559 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.6 p-80 -80.42 -17.5 51.6 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.296 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 7.2 mt -71.13 -38.53 72.28 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.484 ' HG2' HD23 ' B' ' 62' ' ' LEU . 63.2 mt-30 -73.87 -27.21 60.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.54 ' HB2' ' O ' ' C' ' 101' ' ' HIS . . . -59.51 -56.96 15.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.299 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -62.16 -44.45 96.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.155 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -52.92 -26.88 16.36 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.022 179.461 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 34.4 t -53.14 -37.84 62.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.684 0.278 . . . . 0.0 111.194 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.591 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 25.1 pt20 -87.0 -35.9 18.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.368 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.691 ' OH ' ' HD2' ' A' ' 30' ' ' LYS . 28.7 m-85 -74.21 -19.93 60.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.361 0.6 . . . . 0.0 110.85 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.742 ' HD2' ' OH ' ' B' ' 69' ' ' TYR . 32.0 tptt -64.67 -40.8 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.994 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -95.06 31.71 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.481 0.658 . . . . 0.0 110.753 179.08 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.526 ' HB ' ' O ' ' C' ' 109' ' ' TYR . 10.9 t -95.97 -41.38 11.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.954 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.598 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 15.7 tt0 -102.52 101.69 11.89 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-O 122.459 1.124 . . . . 0.0 111.221 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.547 HD23 ' HA ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.3 -1.559 0 CA-C-N 112.651 -2.068 . . . . 0.0 109.723 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 90.1 t . . . . . 0 C--O 1.234 0.238 0 CA-C-O 120.737 0.303 . . . . 0.0 110.69 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.597 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.0 -24.84 64.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.289 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.669 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 70.7 m -69.66 -26.18 64.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.0 tp -73.59 -23.55 59.95 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.053 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.597 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 48.4 mmm-85 -63.45 -23.68 67.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.253 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.4 mt-30 -76.34 -43.21 42.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.522 -179.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 52.0 tt0 -70.03 -29.29 66.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.454 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.9 t -74.6 -36.37 40.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.077 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 88.7 tt0 -66.36 -32.12 73.31 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 177.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.98 -56.73 11.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.283 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.635 ' O ' HG22 ' A' ' 19' ' ' VAL . 4.6 mp -57.7 -39.08 76.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.034 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 20.1 pt20 -70.67 -31.33 68.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.1 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -72.72 -31.14 62.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 119.933 -1.127 . . . . 0.0 111.494 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 14' ' ' ALA . 77.6 mm-40 -76.37 -35.52 58.63 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 120.806 0.336 . . . . 0.0 110.575 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 15' ' ' LEU . 58.7 t -77.16 -32.03 18.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.729 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -67.98 -40.12 83.17 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.487 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.486 ' HD1' ' HA ' ' A' ' 18' ' ' GLN . 6.8 p-80 -80.44 -25.6 38.86 Favored 'General case' 0 N--CA 1.46 0.049 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.928 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.675 ' HG ' ' HD2' ' B' ' 66' ' ' PHE . 0.1 OUTLIER -72.87 -39.73 66.22 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.863 178.475 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.668 ' HG3' HD22 ' C' ' 102' ' ' LEU . 26.6 tt0 -70.71 -36.86 73.44 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.87 -56.61 19.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.967 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -48.21 82.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.77 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.495 ' HE2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.54 -24.84 22.53 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.064 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.2 t -49.61 -32.2 12.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.64 0.257 . . . . 0.0 111.04 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.436 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 12.9 mm100 -96.3 -45.63 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.081 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.546 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.8 m-85 -66.47 -20.08 65.95 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -73.24 -4.4 32.82 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.908 0.385 . . . . 0.0 110.868 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.76 36.06 4.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.983 0.897 . . . . 0.0 108.73 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.546 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 12.8 t -100.58 -34.63 4.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.127 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -85.62 81.64 8.57 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 122.969 1.366 . . . . 0.0 111.417 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.292 -1.922 0 CA-C-N 111.95 -2.387 . . . . 0.0 109.539 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 97.7 t . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.924 0.393 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.612 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -68.84 -25.58 64.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.244 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.692 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 73.4 m -69.01 -26.22 64.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 55.7 tp -73.1 -23.79 60.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.066 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.612 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 47.8 mmm-85 -63.81 -21.85 66.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.973 0.415 . . . . 0.0 110.215 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.8 mt-30 -77.94 -43.68 29.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.287 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 52.0 tt0 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.622 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 26.7 t -74.85 -37.79 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.37 -31.79 73.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.513 ' O ' ' HG2' ' B' ' 58' ' ' GLN . . . -65.35 -56.58 11.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.442 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.623 ' O ' HG22 ' B' ' 59' ' ' VAL . 4.7 mp -57.68 -39.23 76.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.93 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -70.35 -31.95 69.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.087 -179.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -71.98 -30.89 64.98 Favored Glycine 0 C--O 1.238 0.396 0 C-N-CA 120.08 -1.057 . . . . 0.0 111.373 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' B' ' 54' ' ' ALA . 77.0 mm-40 -76.58 -36.49 57.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.795 0.331 . . . . 0.0 110.528 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.623 HG22 ' O ' ' B' ' 55' ' ' LEU . 59.9 t -76.28 -31.29 20.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 122.256 -0.278 . . . . 0.0 110.711 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -69.02 -40.51 78.62 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.279 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.5 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 6.8 p-80 -80.18 -24.97 39.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 119.856 -0.738 . . . . 0.0 111.061 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.63 ' HG ' ' HD2' ' C' ' 106' ' ' PHE . 0.1 OUTLIER -74.03 -39.5 63.53 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.584 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.463 ' HG3' ' CD1' ' A' ' 22' ' ' LEU . 23.3 tt0 -69.93 -38.72 76.29 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.57 30.6 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.122 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.51 -48.03 82.9 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.675 ' HD2' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.65 -24.39 21.45 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.286 -179.615 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -49.96 -31.88 13.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.772 0.32 . . . . 0.0 110.999 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' B' ' 71' ' ' LYS . 12.8 mm100 -96.83 -44.86 6.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 111.096 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.531 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.4 m-85 -67.12 -19.69 65.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -73.57 -4.07 31.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.023 0.439 . . . . 0.0 110.786 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -127.98 35.89 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.782 0.801 . . . . 0.0 109.012 177.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.531 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 11.8 t -100.33 -34.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.101 -179.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -84.79 80.89 9.11 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 123.11 1.434 . . . . 0.0 111.402 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.292 -1.893 0 CA-C-N 111.978 -2.374 . . . . 0.0 109.926 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 92.1 t . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 120.84 0.352 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.626 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.68 -25.02 64.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.283 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.683 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 73.4 m -69.67 -25.75 64.05 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 54.9 tp -73.77 -23.6 59.74 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.984 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 48.3 mmm-85 -64.21 -21.7 66.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.194 178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.683 ' HG3' ' O ' ' C' ' 87' ' ' SER . 3.8 mt-30 -78.45 -43.47 27.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.027 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 51.8 tt0 -69.42 -29.91 67.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.728 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 25.3 t -74.71 -36.14 39.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.819 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 87.5 tt0 -66.03 -31.27 72.06 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -66.02 -56.42 11.69 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.249 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.633 ' O ' HG22 ' C' ' 99' ' ' VAL . 7.3 mt -57.05 -40.33 76.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.703 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 20.0 pt20 -70.06 -32.32 70.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.397 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.581 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -71.62 -31.66 65.09 Favored Glycine 0 C--O 1.239 0.451 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.268 178.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' C' ' 94' ' ' ALA . 77.0 mm-40 -76.2 -34.91 59.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.674 0.273 . . . . 0.0 110.706 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.633 HG22 ' O ' ' C' ' 95' ' ' LEU . 60.1 t -77.52 -31.46 17.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.697 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -68.71 -38.72 80.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.324 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.577 ' CE1' HD23 ' C' ' 102' ' ' LEU . 6.3 p-80 -81.77 -26.41 34.47 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.604 -0.839 . . . . 0.0 111.097 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.668 HD22 ' HG3' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -67.54 -47.09 70.88 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.712 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.406 ' HG3' ' CD1' ' B' ' 62' ' ' LEU . 24.2 tt0 -67.51 -38.38 84.21 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.31 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.43 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -55.64 -55.96 25.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.002 178.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.01 -47.78 84.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.993 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.63 ' HD2' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -54.93 -24.01 21.66 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.968 -179.432 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.2 t -50.44 -31.04 14.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.638 0.256 . . . . 0.0 110.841 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' C' ' 111' ' ' LYS . 12.8 mm100 -97.58 -46.0 6.19 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.002 178.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.574 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 15.5 m-85 -65.98 -19.98 66.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -72.75 -5.15 35.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.024 0.44 . . . . 0.0 110.856 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -126.8 35.39 4.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.97 0.891 . . . . 0.0 108.908 177.636 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.574 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -99.4 -34.81 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.236 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -85.19 81.43 8.83 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 123.081 1.42 . . . . 0.0 111.427 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.29 -2.005 0 CA-C-N 112.029 -2.35 . . . . 0.0 109.62 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.454 -0.25 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.654 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.8 -27.0 62.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.393 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 66.2 m -71.0 -17.49 62.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.813 0.816 . . . . 0.0 109.247 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.6 tp -78.21 -21.83 49.46 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.485 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -69.62 -16.65 63.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.46 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.417 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 9.0 mm-40 -77.87 -40.02 41.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.774 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.526 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 3.7 tp-100 -73.24 -25.18 60.62 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.014 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.87 -45.92 54.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.8 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -67.53 -26.91 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB1' ' O ' ' A' ' 11' ' ' GLN . . . -63.07 -54.29 40.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.36 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.551 HD11 ' HA ' ' B' ' 56' ' ' GLN . 13.1 tp -60.86 -32.96 72.37 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.647 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.613 ' O ' HG11 ' A' ' 19' ' ' VAL . 10.3 tt0 -63.6 -36.42 83.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.33 178.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.21 -31.43 76.94 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.803 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.62 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 71.0 mt-30 -73.98 -47.54 36.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.093 0.473 . . . . 0.0 111.213 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.613 HG11 ' O ' ' A' ' 16' ' ' GLN . 7.6 p -66.48 -36.16 76.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -65.78 -44.58 85.35 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.869 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.531 ' O ' ' HB1' ' A' ' 24' ' ' ALA . 7.7 p-80 -75.36 -13.76 60.43 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.368 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -73.58 -34.69 65.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.29 -35.41 77.8 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.531 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -57.41 -50.69 72.18 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.531 178.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.494 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.79 -42.46 99.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.056 178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 6.6 m-85 -56.27 -27.28 54.71 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.71 179.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t -54.63 -27.13 37.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.164 0.507 . . . . 0.0 110.606 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.644 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 87.4 mm-40 -94.68 -37.6 11.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.607 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.564 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 37.7 m-85 -77.98 -18.81 55.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 0.0 111.481 -179.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 4.2 tmtt? -58.04 -49.88 75.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.42 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.647 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER -88.77 39.46 0.92 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.206 1.003 . . . . 0.0 110.501 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.683 HG21 ' HA ' ' B' ' 73' ' ' GLU . 51.4 t -125.1 -10.55 5.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.673 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.766 ' HG3' HD12 ' A' ' 34' ' ' LEU . 10.8 pt-20 -75.45 -35.19 60.95 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.766 HD12 ' HG3' ' A' ' 33' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.476 0 CA-C-O 121.862 0.839 . . . . 0.0 112.732 -177.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.455 -0.223 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.652 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.27 -25.84 61.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.34 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 68.2 m -71.74 -17.56 62.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.933 0.873 . . . . 0.0 109.429 178.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 61.4 tp -78.02 -22.68 48.87 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.269 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 0.3 OUTLIER -68.85 -15.57 63.53 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.444 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.451 ' H ' ' HG2' ' B' ' 50' ' ' GLN . 8.5 mm-40 -79.57 -39.34 31.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.767 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.523 ' O ' ' HB1' ' B' ' 54' ' ' ALA . 3.8 tp-100 -74.16 -25.04 59.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.833 0.825 . . . . 0.0 109.037 178.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.89 -45.66 54.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.7 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -68.04 -26.58 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.523 ' HB1' ' O ' ' B' ' 51' ' ' GLN . . . -63.89 -52.97 57.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.604 HD11 ' HA ' ' C' ' 96' ' ' GLN . 13.3 tp -62.11 -32.36 72.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.632 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.602 ' O ' HG11 ' B' ' 59' ' ' VAL . 9.0 tt0 -64.31 -35.73 81.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.219 178.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.415 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.71 -31.28 77.45 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.84 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.606 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.3 mt-30 -73.88 -47.77 35.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.035 0.445 . . . . 0.0 110.982 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.602 HG11 ' O ' ' B' ' 56' ' ' GLN . 7.5 p -66.27 -36.23 76.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.6 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 17.4 pt20 -65.64 -44.47 86.3 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.664 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.547 ' O ' ' HB1' ' B' ' 64' ' ' ALA . 7.5 p-80 -75.59 -13.46 60.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.651 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.3 mt -74.22 -35.09 63.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -67.79 -35.6 78.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.547 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -57.06 -51.4 69.42 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.508 -1.223 . . . . 0.0 109.378 177.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.507 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.63 -43.41 97.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.884 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 7.4 m-85 -55.53 -28.24 53.6 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.679 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.7 t -53.66 -27.41 27.32 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.249 0.547 . . . . 0.0 110.775 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.666 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 89.6 mm-40 -94.64 -38.65 10.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.496 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.544 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 36.0 m-85 -77.04 -18.58 58.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.919 0.39 . . . . 0.0 111.675 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 4.5 tmtt? -58.77 -49.08 78.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.363 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.666 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.2 OUTLIER -89.25 39.65 0.95 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.989 0.899 . . . . 0.0 110.363 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.7 HG21 ' HA ' ' C' ' 113' ' ' GLU . 55.6 t -125.66 -9.87 5.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.734 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.777 ' HG3' HD12 ' B' ' 74' ' ' LEU . 12.1 pt-20 -76.27 -34.24 59.12 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.777 HD12 ' HG3' ' B' ' 73' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 121.909 0.862 . . . . 0.0 112.972 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.15 -26.27 62.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.464 . . . . 0.0 110.414 178.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 70.6 m -70.7 -17.65 62.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.917 0.865 . . . . 0.0 109.415 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.674 ' O ' HG12 ' C' ' 92' ' ' VAL . 53.1 tp -79.23 -22.99 44.03 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.654 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -69.79 -12.56 61.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.459 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.44 27.57 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.455 ' O ' ' HB1' ' C' ' 94' ' ' ALA . 3.3 tp-100 -75.01 -27.11 59.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.906 177.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.674 HG12 ' O ' ' C' ' 88' ' ' LEU . 1.5 m -75.76 -38.08 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.561 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.503 ' N ' HG21 ' C' ' 92' ' ' VAL . 35.8 tt0 -68.38 -27.87 66.62 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.455 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -63.99 -52.41 59.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.15 178.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' A' ' 16' ' ' GLN . 13.1 tp -61.47 -33.46 73.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.738 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.611 ' O ' HG11 ' C' ' 99' ' ' VAL . 10.6 tt0 -63.54 -35.72 81.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.391 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.421 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.5 -31.64 78.31 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.755 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.611 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 64.0 mt-30 -74.05 -47.37 37.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.097 0.475 . . . . 0.0 111.137 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.611 HG11 ' O ' ' C' ' 96' ' ' GLN . 7.6 p -66.53 -35.58 75.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.811 -179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 16.4 pt20 -66.35 -44.29 83.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.951 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.554 ' O ' ' HB1' ' C' ' 104' ' ' ALA . 8.7 p-80 -75.88 -13.46 60.27 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 6.2 mt -72.93 -35.84 67.11 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -67.3 -36.03 80.68 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 176.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.554 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -56.46 -51.38 68.64 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.621 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.518 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.23 -42.81 99.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.291 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.561 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 15.6 m-85 -56.05 -27.88 55.21 Favored 'General case' 0 C--O 1.214 -0.816 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.563 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 24.1 t -52.99 -26.45 15.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.151 0.5 . . . . 0.0 110.694 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.711 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 91.2 mm-40 -96.49 -37.75 10.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.57 ' O ' ' HB ' ' C' ' 112' ' ' VAL . 37.0 m-85 -78.32 -18.95 54.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.997 0.427 . . . . 0.0 111.494 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' C' ' 106' ' ' PHE . 3.7 tmtt? -58.79 -47.39 84.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.598 -179.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.2 OUTLIER -90.47 38.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.095 0.95 . . . . 0.0 110.138 178.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.75 HG21 ' HA ' ' A' ' 33' ' ' GLU . 53.6 t -124.48 -10.37 6.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.813 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.754 ' HG3' HD12 ' C' ' 114' ' ' LEU . 10.4 pt-20 -75.37 -36.4 60.95 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.754 HD12 ' HG3' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.554 0 CA-C-O 121.979 0.895 . . . . 0.0 113.023 -177.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.424 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 90.2 t . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.958 0.409 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.946 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.99 -25.77 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.832 179.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.685 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 67.7 m -71.69 -22.31 61.67 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.519 HD23 HD23 ' B' ' 48' ' ' LEU . 62.1 tp -78.92 -26.3 43.69 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.799 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.946 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -64.23 -49.0 73.68 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.491 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.4 pt20 -61.99 -48.5 80.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.108 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.485 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 15.8 pt20 -68.41 -21.24 64.69 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.198 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.36 -34.92 21.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.716 ' HA ' HE21 ' A' ' 16' ' ' GLN . 48.9 mt-10 -70.1 -28.03 65.08 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -64.91 -58.57 5.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.177 178.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.5 HD21 HG12 ' B' ' 59' ' ' VAL . 1.2 tm? -62.01 -36.28 81.07 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.703 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.716 HE21 ' HA ' ' A' ' 13' ' ' GLU . 9.4 pt20 -71.06 -22.3 62.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.675 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -69.05 -32.8 73.35 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.056 -1.068 . . . . 0.0 110.655 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.753 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 54.1 mt-30 -72.65 -49.85 29.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.47 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.552 ' HB ' HG23 ' B' ' 59' ' ' VAL . 2.9 p -67.42 -28.71 43.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.833 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 13.2 pt20 -67.38 -43.93 80.2 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.407 ' HA ' ' HB1' ' A' ' 24' ' ' ALA . 7.2 p-80 -77.73 -18.34 56.64 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.139 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.753 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 44.9 mt -72.24 -40.27 67.85 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.502 HE21 ' HB3' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -70.79 -36.85 73.22 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -57.03 -54.87 41.8 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.098 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB3' ' HE2' ' A' ' 29' ' ' TYR . . . -61.58 -44.39 97.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.402 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.483 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -54.93 -26.53 36.75 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.422 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -50.15 -24.79 2.98 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.88 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.684 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 99.0 mm-40 -102.27 -41.09 6.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.375 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.689 ' HA ' HG22 ' A' ' 32' ' ' VAL . 38.5 m-85 -73.28 -19.59 61.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -178.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 26' ' ' PHE . 43.1 mtmt -69.95 -8.86 52.33 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.855 0.359 . . . . 0.0 110.726 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.684 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.81 37.05 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.74 0.781 . . . . 0.0 109.78 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.689 HG22 ' HA ' ' A' ' 29' ' ' TYR . 8.2 t -100.95 -43.27 10.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.134 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.48 ' HB2' HG11 ' C' ' 112' ' ' VAL . 31.9 tt0 -87.4 88.92 7.81 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 122.613 1.196 . . . . 0.0 111.259 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.467 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.034 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.552 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 96.6 t . . . . . 0 N--CA 1.455 -0.178 0 CA-C-O 120.665 0.269 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.979 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.36 -25.6 61.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.869 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.672 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 66.4 m -71.86 -21.92 61.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.519 HD23 HD23 ' A' ' 8' ' ' LEU . 62.3 tp -79.29 -26.46 42.3 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.434 177.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.979 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -63.34 -49.46 73.84 Favored 'General case' 0 N--CA 1.461 0.106 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.25 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.5 pt20 -62.21 -48.25 80.82 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.295 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.484 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 15.9 pt20 -68.21 -21.64 64.84 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 120.145 -0.622 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -34.79 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.749 ' HA ' HE21 ' B' ' 56' ' ' GLN . 48.4 mt-10 -69.54 -30.13 67.88 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -62.99 -59.12 5.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.521 178.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -61.6 -35.47 77.96 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.749 HE21 ' HA ' ' B' ' 53' ' ' GLU . 9.2 pt20 -71.57 -22.21 61.77 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.769 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.688 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -68.9 -33.97 76.14 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.762 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 55.5 mt-30 -71.48 -48.95 45.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.069 0.461 . . . . 0.0 110.575 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.552 HG23 ' HB ' ' A' ' 19' ' ' VAL . 2.9 p -68.77 -28.05 38.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.814 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.688 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 13.3 pt20 -67.7 -43.26 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.439 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.415 ' HA ' ' HB1' ' B' ' 64' ' ' ALA . 7.3 p-80 -78.31 -19.11 54.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.991 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 50.7 mt -71.55 -40.73 69.84 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.438 HE21 ' HB3' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -70.29 -37.34 74.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.415 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -56.45 -55.33 35.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.149 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.444 ' HB3' ' HE2' ' B' ' 69' ' ' TYR . . . -61.18 -44.75 96.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.377 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.519 ' HD1' ' HB2' ' B' ' 69' ' ' TYR . 0.0 OUTLIER -54.84 -26.5 35.63 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.336 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -48.9 -27.49 3.13 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.984 0.421 . . . . 0.0 110.595 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.725 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 96.7 mm-40 -99.92 -41.14 7.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.725 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.692 ' HA ' HG22 ' B' ' 72' ' ' VAL . 38.6 m-85 -72.85 -19.83 61.23 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 66' ' ' PHE . 41.5 mtmt -69.5 -8.34 46.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.67 0.271 . . . . 0.0 110.745 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.725 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -129.44 38.12 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.133 0.968 . . . . 0.0 109.782 178.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.692 HG22 ' HA ' ' B' ' 69' ' ' TYR . 10.4 t -101.61 -43.57 10.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.809 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.517 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 31.4 tt0 -87.68 89.38 7.97 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 122.742 1.258 . . . . 0.0 111.314 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.487 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.29 -2.003 0 CA-C-N 112.313 -2.221 . . . . 0.0 109.4 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.427 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 84.7 t . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 120.939 0.4 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 1.016 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.62 -25.24 61.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.845 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.666 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 64.2 m -72.48 -21.21 61.25 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.488 HD23 HD23 ' A' ' 8' ' ' LEU . 63.4 tp -79.9 -26.3 40.27 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.626 177.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 1.016 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.7 OUTLIER -64.23 -48.14 76.95 Favored 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.666 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.5 pt20 -63.5 -47.7 80.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.931 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' C' ' 88' ' ' LEU . 16.1 pt20 -69.21 -20.51 63.98 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 119.999 -0.68 . . . . 0.0 111.0 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.05 -34.68 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.688 ' HA ' HE21 ' C' ' 96' ' ' GLN . 47.4 mt-10 -69.86 -30.32 67.76 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -61.58 -59.8 4.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.088 -1.415 . . . . 0.0 110.092 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.69 -38.81 89.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.455 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.688 HE21 ' HA ' ' C' ' 93' ' ' GLU . 10.0 pt20 -66.64 -22.1 66.11 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.564 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.659 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -68.6 -32.95 75.38 Favored Glycine 0 C--O 1.24 0.473 0 C-N-CA 120.084 -1.055 . . . . 0.0 110.753 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.78 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 52.7 mt-30 -72.04 -46.97 54.99 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.665 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.77 -37.55 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.125 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.659 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 14.6 pt20 -62.34 -42.14 99.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -177.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.474 ' HA ' ' HB1' ' C' ' 104' ' ' ALA . 6.4 p-80 -80.48 -17.83 50.45 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.44 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.78 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 48.4 mt -73.53 -40.49 63.96 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.464 HE21 ' HB3' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -71.1 -37.57 72.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.661 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.474 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -56.69 -55.88 28.53 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.043 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.458 ' HB3' ' HE2' ' C' ' 109' ' ' TYR . . . -61.85 -44.08 97.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.46 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.471 ' HD1' ' HB2' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -55.0 -25.23 28.53 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.596 -179.82 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 32.0 t -51.33 -26.23 7.25 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.09 0.471 . . . . 0.0 110.887 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.688 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 99.2 mm-40 -100.72 -40.76 7.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.321 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.69 ' HA ' HG12 ' C' ' 112' ' ' VAL . 39.5 m-85 -73.1 -19.21 61.2 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' C' ' 106' ' ' PHE . 43.9 mtmt -69.53 -8.88 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.652 0.263 . . . . 0.0 110.435 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -127.85 34.41 4.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.599 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.69 HG12 ' HA ' ' C' ' 109' ' ' TYR . 0.8 OUTLIER -103.44 -35.03 3.6 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.399 177.759 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.508 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 31.3 tt0 -85.85 87.24 7.38 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.849 1.309 . . . . 0.0 110.454 178.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.458 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.29 -2.0 0 CA-C-N 112.14 -2.3 . . . . 0.0 109.313 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 91.1 t . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.613 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.58 -29.52 68.9 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.681 179.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.663 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.0 m -67.03 -23.41 65.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.394 0.616 . . . . 0.0 109.736 178.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.551 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 68.0 tp -79.39 -24.66 42.45 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.449 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.613 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 12.7 mmm-85 -71.83 -33.69 68.7 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.663 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -75.19 -42.61 55.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.379 179.093 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.468 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 97.3 mm-40 -65.2 -32.8 74.66 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.401 0.619 . . . . 0.0 110.308 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -77.91 -26.94 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.172 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -69.55 -30.62 68.47 Favored 'General case' 0 C--O 1.227 -0.091 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.468 ' HB1' ' O ' ' A' ' 11' ' ' GLN . . . -68.14 -51.41 46.39 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.69 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD13 ' HB2' ' B' ' 56' ' ' GLN . 52.1 mt -58.7 -31.92 68.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.073 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.552 ' O ' HG11 ' A' ' 19' ' ' VAL . 21.1 tt0 -70.6 -48.26 56.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.711 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.453 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -59.61 -29.69 67.36 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.602 -0.809 . . . . 0.0 111.435 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.711 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.35 -50.51 21.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.045 0.45 . . . . 0.0 111.065 179.579 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG11 ' O ' ' A' ' 16' ' ' GLN . 14.5 p -67.62 -31.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.5 pt20 -70.45 -41.53 72.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.811 -0.177 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.408 ' O ' ' HB1' ' A' ' 24' ' ' ALA . 6.4 p-80 -78.07 -18.31 55.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.239 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 15.3 mt -71.19 -40.29 71.31 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.001 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.14 -34.01 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -56.93 -55.68 31.44 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.296 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.434 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -62.96 -39.08 93.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.479 178.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.492 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -55.73 -26.49 45.71 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.516 179.459 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.9 t -50.2 -32.54 16.69 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.225 0.536 . . . . 0.0 110.371 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.755 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 16.2 mm100 -87.88 -53.69 4.62 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.342 177.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.772 ' HA ' HG23 ' A' ' 32' ' ' VAL . 14.1 m-85 -60.7 -20.59 61.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 14.7 mttp -66.11 -35.35 80.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.497 0.189 . . . . 0.0 110.822 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.755 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -100.35 33.17 2.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.232 0.539 . . . . 0.0 110.825 179.591 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.772 HG23 ' HA ' ' A' ' 29' ' ' TYR . 67.5 t -97.24 -43.97 12.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.708 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.618 ' HB2' HG22 ' C' ' 112' ' ' VAL . 7.0 tt0 -119.74 105.48 11.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.315 1.055 . . . . 0.0 109.583 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.62 HD13 ' HA ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.67 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.007 -178.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 85.6 t . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.631 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.87 -29.15 68.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.811 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 53.7 m -67.29 -23.33 65.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.42 0.628 . . . . 0.0 109.847 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.547 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 66.8 tp -79.57 -24.6 41.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.295 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.631 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 13.2 mmm-85 -71.62 -33.44 68.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -75.8 -41.81 51.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.425 179.221 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' B' ' 47' ' ' SER . 97.2 mm-40 -65.57 -33.42 75.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.563 0.697 . . . . 0.0 110.083 178.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 0.3 OUTLIER -76.99 -27.07 16.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.261 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -69.58 -31.35 69.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' B' ' 51' ' ' GLN . . . -67.6 -50.72 56.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.077 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 52.6 mt -59.04 -32.47 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.967 179.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.546 ' O ' HG11 ' B' ' 59' ' ' VAL . 22.6 tt0 -70.26 -48.0 58.78 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.715 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.435 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.97 -29.13 67.29 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.515 -0.85 . . . . 0.0 111.653 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.737 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -74.03 -50.05 21.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.936 0.398 . . . . 0.0 110.96 179.453 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.546 HG11 ' O ' ' B' ' 56' ' ' GLN . 14.8 p -67.84 -31.8 53.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 122.131 -0.356 . . . . 0.0 111.902 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.6 pt20 -70.23 -41.74 73.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.779 -0.192 . . . . 0.0 110.836 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.408 ' HA ' ' HB1' ' B' ' 64' ' ' ALA . 6.5 p-80 -78.17 -18.38 55.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.762 -0.775 . . . . 0.0 110.463 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.737 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 16.5 mt -71.41 -39.16 71.29 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -71.85 -33.72 68.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.408 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -57.51 -55.19 38.03 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.3 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.407 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -63.41 -39.21 93.88 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.354 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.505 ' HD1' ' HB2' ' B' ' 69' ' ' TYR . 0.0 OUTLIER -55.95 -26.13 46.6 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.457 179.329 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -50.74 -31.78 17.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.201 0.524 . . . . 0.0 110.226 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.732 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 15.9 mm100 -88.09 -53.51 4.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.413 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.804 ' HA ' HG23 ' B' ' 72' ' ' VAL . 13.2 m-85 -60.97 -20.95 63.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 14.7 mttp -65.66 -36.08 82.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.877 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.732 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -99.6 33.11 2.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.481 0.658 . . . . 0.0 110.989 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.804 HG23 ' HA ' ' B' ' 69' ' ' TYR . 62.5 t -96.82 -43.55 12.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.789 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.56 ' HB2' HG22 ' A' ' 32' ' ' VAL . 5.8 tt0 -120.29 105.61 11.09 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.301 1.048 . . . . 0.0 109.733 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.644 0 CA-C-N 112.771 -2.013 . . . . 0.0 108.686 -178.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 88.0 t . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.561 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.77 -29.42 68.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.924 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 54.4 m -67.05 -23.78 65.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.471 0.653 . . . . 0.0 109.524 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.403 HD12 HG11 ' A' ' 12' ' ' VAL . 66.9 tp -78.15 -25.6 47.38 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.78 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.561 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 10.2 mmm-85 -72.5 -31.14 65.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -76.26 -40.81 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.474 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' C' ' 87' ' ' SER . 97.4 mm-40 -65.82 -34.45 78.18 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.534 HG23 ' O ' ' C' ' 89' ' ' ARG . 1.1 m -74.59 -28.99 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.468 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -65.94 -32.44 73.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -67.53 -52.53 37.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.912 178.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.75 -34.44 67.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.119 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.529 ' O ' HG11 ' C' ' 99' ' ' VAL . 22.0 tt0 -69.68 -48.07 60.99 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.655 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -59.39 -29.62 66.6 Favored Glycine 0 C--O 1.237 0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.545 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.727 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -74.17 -50.44 19.29 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.406 -0.397 . . . . 0.0 111.047 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.529 HG11 ' O ' ' C' ' 96' ' ' GLN . 14.9 p -67.5 -31.88 54.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 17.0 pt20 -70.02 -42.3 73.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.942 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.4 ' HD1' ' HA ' ' C' ' 98' ' ' GLN . 6.4 p-80 -77.58 -18.1 57.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.589 -0.845 . . . . 0.0 110.253 179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.6 mt -71.26 -39.57 71.51 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.441 ' HG2' HD22 ' B' ' 62' ' ' LEU . 0.7 OUTLIER -71.1 -34.99 71.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.27 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.89 -56.07 26.36 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.425 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.419 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -62.7 -38.28 89.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.584 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.496 ' HD1' ' HB2' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -56.89 -26.12 58.26 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.439 179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.1 t -50.37 -32.66 18.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.095 0.474 . . . . 0.0 109.951 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.749 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 15.9 mm100 -87.68 -53.02 5.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.645 177.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.824 ' HA ' HG23 ' C' ' 112' ' ' VAL . 13.2 m-85 -61.6 -20.54 63.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.464 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 14.5 mttp -65.91 -36.06 82.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.635 0.255 . . . . 0.0 110.686 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -99.3 33.03 2.54 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.157 0.503 . . . . 0.0 111.055 179.241 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.824 HG23 ' HA ' ' C' ' 109' ' ' TYR . 60.0 t -96.94 -43.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.852 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.616 ' HB2' HG22 ' B' ' 72' ' ' VAL . 6.4 tt0 -120.47 105.66 11.08 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 122.45 1.119 . . . . 0.0 109.741 176.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.621 HD23 ' N ' ' C' ' 114' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.763 0 CA-C-N 112.783 -2.008 . . . . 0.0 108.84 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 121.046 0.45 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.696 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.12 -24.17 65.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.282 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.685 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -68.04 -29.01 67.89 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-O 121.721 0.772 . . . . 0.0 109.125 178.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 51.1 tp -75.75 -22.4 56.54 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.152 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.696 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 41.3 mmm-85 -65.77 -37.58 86.72 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.03 -43.79 81.9 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.656 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.514 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.9 tt0 -63.6 -31.3 72.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.89 0.852 . . . . 0.0 109.61 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.55 -28.91 29.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.769 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.784 ' HA ' HE21 ' A' ' 16' ' ' GLN . 58.0 mt-10 -68.15 -29.47 68.36 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.01 -55.4 12.76 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.314 177.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -36.84 77.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.827 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.784 HE21 ' HA ' ' A' ' 13' ' ' GLU . 24.7 pt20 -75.13 -26.83 59.48 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.181 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.585 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -68.63 -33.49 76.4 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 177.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.717 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 93.1 mm-40 -70.76 -48.62 53.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.837 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 16' ' ' GLN . 6.1 p -67.43 -33.96 65.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.585 HE21 ' HA2' ' A' ' 17' ' ' GLY . 15.9 pt20 -66.6 -45.7 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.941 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.564 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.9 p-80 -74.57 -17.52 60.71 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 119.736 -0.786 . . . . 0.0 110.433 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.8 mt -72.05 -37.8 69.6 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.585 ' HG2' HD22 ' C' ' 102' ' ' LEU . 74.1 mt-30 -70.88 -30.38 66.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.43 -59.19 5.52 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.465 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.613 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.43 -39.68 91.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.117 178.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -56.27 -26.61 52.41 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -59.22 -28.18 66.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.822 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.619 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 14.5 mm100 -89.59 -33.87 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.613 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 21.6 m-85 -78.45 -18.4 54.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.581 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HA ' ' OH ' ' C' ' 109' ' ' TYR . 8.5 tmtt? -55.47 -46.73 76.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.303 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.666 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -91.13 37.29 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.408 0.623 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 32' ' ' VAL . 96.2 t -121.19 3.85 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.97 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.56 ' HB3' ' CE1' ' C' ' 109' ' ' TYR . 9.5 pt-20 -93.85 -27.63 16.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 O-C-N 121.681 -0.637 . . . . 0.0 112.288 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 121.479 0.657 . . . . 0.0 110.499 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.875 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.716 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.34 -23.65 65.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.157 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 68.1 m -68.38 -28.41 67.08 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.856 0.836 . . . . 0.0 109.35 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.415 HD21 ' HD2' ' C' ' 89' ' ' ARG . 54.3 tp -76.61 -22.54 54.04 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.885 178.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.716 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 41.7 mmm-85 -65.25 -38.59 90.8 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -66.58 -43.8 83.95 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.048 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.508 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 38.6 tt0 -62.96 -31.87 73.07 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.983 0.897 . . . . 0.0 109.377 178.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -29.58 32.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.841 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . 0.727 ' HA ' HE21 ' B' ' 56' ' ' GLN . 54.9 mt-10 -67.45 -28.37 67.82 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.01 -55.69 10.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.18 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.27 -37.46 77.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.739 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.727 HE21 ' HA ' ' B' ' 53' ' ' GLU . 24.3 pt20 -74.43 -27.36 60.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.487 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.584 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -68.7 -32.78 74.74 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.732 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 94.4 mm-40 -70.65 -49.2 49.89 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 121.017 0.437 . . . . 0.0 111.011 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.571 HG12 ' HA ' ' B' ' 56' ' ' GLN . 5.7 p -67.2 -33.95 66.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.584 HE21 ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -66.41 -45.6 79.38 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.119 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.551 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 7.3 p-80 -74.62 -17.76 60.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.451 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.8 mt -71.93 -38.46 69.85 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.589 ' HG2' HD22 ' A' ' 22' ' ' LEU . 73.7 mt-30 -70.23 -30.95 68.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.21 -58.13 9.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.722 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.612 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.05 -40.0 94.28 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.082 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.435 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.55 -25.9 53.38 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.083 -179.849 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -59.71 -28.92 67.74 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.639 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . 0.659 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 14.5 mm100 -89.07 -33.35 17.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.753 0.311 . . . . 0.0 111.007 179.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.612 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.8 m-85 -78.84 -17.48 55.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.694 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.486 ' HA ' ' OH ' ' A' ' 29' ' ' TYR . 8.7 tmtt? -56.31 -47.32 78.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.377 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.677 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.5 OUTLIER -90.09 37.23 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.184 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.608 HG12 ' O ' ' B' ' 72' ' ' VAL . 99.4 t -120.84 2.63 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.074 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.557 ' HB3' ' CE1' ' A' ' 29' ' ' TYR . 9.5 pt-20 -93.02 -26.76 17.37 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.599 -0.688 . . . . 0.0 112.194 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.419 ' N ' HD22 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.355 0 CA-C-O 121.363 0.601 . . . . 0.0 110.295 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.027 0.442 . . . . 0.0 109.855 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.664 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.59 -25.97 66.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.196 179.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.652 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 66.7 m -66.64 -28.56 68.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.745 0.783 . . . . 0.0 109.237 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.616 ' O ' HG13 ' C' ' 92' ' ' VAL . 46.5 tp -75.76 -25.07 56.16 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.116 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.664 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 34.8 mmm-85 -65.43 -35.88 82.25 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.34 -43.26 82.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.364 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.42 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.3 tt0 -63.6 -32.43 73.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.75 178.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.616 HG13 ' O ' ' C' ' 88' ' ' LEU . 6.0 m -74.91 -23.05 17.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.879 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.755 ' HA ' HE21 ' C' ' 96' ' ' GLN . 55.8 mt-10 -67.96 -29.81 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.46 -55.1 11.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.135 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . 0.424 ' O ' HG22 ' C' ' 99' ' ' VAL . 3.4 mm? -59.1 -37.92 78.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.685 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.755 HE21 ' HA ' ' C' ' 93' ' ' GLU . 24.1 pt20 -73.78 -28.03 61.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.412 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.714 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -67.09 -33.07 82.28 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.724 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 92.6 mm-40 -70.15 -47.26 62.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.159 -0.52 . . . . 0.0 110.422 178.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.642 HG21 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.735 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.714 HE21 ' HA2' ' C' ' 97' ' ' GLY . 17.4 pt20 -59.7 -44.84 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.455 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.551 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 7.2 p-80 -76.83 -18.82 58.15 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.504 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.2 mt -70.93 -38.24 72.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.632 ' HG2' HD22 ' B' ' 62' ' ' LEU . 72.9 mt-30 -72.08 -30.07 64.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.96 -57.7 11.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.468 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.633 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.62 -40.3 96.54 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.828 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.15 -25.82 47.87 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.346 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 13.1 t -60.28 -27.83 67.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 0.0 110.72 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . 0.652 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 14.6 mm100 -89.75 -32.69 16.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.828 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.633 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 22.1 m-85 -79.17 -18.29 53.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.664 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.474 ' HA ' ' OH ' ' B' ' 69' ' ' TYR . 9.0 tmtt? -55.46 -47.33 76.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.62 -179.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . 0.701 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.4 OUTLIER -90.12 38.08 0.92 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.419 0.628 . . . . 0.0 111.111 179.626 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.588 ' O ' HG12 ' C' ' 112' ' ' VAL . 92.7 t -122.15 2.66 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.339 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.522 ' HB3' ' CE1' ' B' ' 69' ' ' TYR . 9.8 pt-20 -92.04 -29.55 16.52 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.355 -0.841 . . . . 0.0 112.452 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.476 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.702 0 C-N-CA 124.033 0.933 . . . . 0.0 110.539 178.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.51 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 44.4 t . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.908 0.385 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.53 -34.95 74.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.312 0.577 . . . . 0.0 109.681 178.915 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.703 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.9 m -71.9 -19.54 61.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.987 0.898 . . . . 0.0 108.695 177.398 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.51 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 36.6 tp -72.62 -28.05 62.52 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.442 179.663 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 29.8 mmm-85 -62.42 -22.71 66.39 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.975 179.075 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.703 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.2 mt-30 -74.28 -35.66 63.76 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.84 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 99.0 mm-40 -71.53 -25.53 62.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 178.16 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.506 HG21 ' O ' ' A' ' 8' ' ' LEU . 60.1 t -75.42 -40.26 42.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.367 178.684 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -62.17 -33.55 74.74 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.73 -55.17 18.76 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 113.974 -1.466 . . . . 0.0 110.772 178.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.11 -45.18 75.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.719 -179.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.633 ' HA ' HG22 ' A' ' 19' ' ' VAL . 23.4 pt20 -72.66 -25.2 61.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 -179.553 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.485 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.75 -31.78 76.63 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 177.552 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.485 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 14.1 mm100 -71.51 -40.34 70.21 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.112 178.392 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.633 HG22 ' HA ' ' A' ' 16' ' ' GLN . 2.9 t -67.12 -44.98 87.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.523 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.485 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.7 pt20 -61.47 -43.09 99.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.678 -178.548 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.485 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.1 p-80 -77.75 -17.63 57.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.175 -179.667 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.599 ' HG ' ' HE2' ' B' ' 66' ' ' PHE . 1.2 mp -77.12 -35.54 56.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 120.099 -0.641 . . . . 0.0 109.56 178.518 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.622 ' HG2' HD21 ' C' ' 102' ' ' LEU . 66.2 mt-30 -74.97 -30.63 61.25 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 21' ' ' HIS . . . -58.29 -53.9 53.04 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.229 177.397 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.68 -46.71 86.65 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.508 178.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.427 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -47.88 -33.1 7.04 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 123.86 0.725 . . . . 0.0 112.502 179.558 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t -53.96 -34.01 58.53 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.853 0.358 . . . . 0.0 111.582 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -86.05 -12.77 49.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.865 0.364 . . . . 0.0 111.522 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.697 ' O ' HG21 ' A' ' 32' ' ' VAL . 62.4 m-85 -103.74 -16.03 15.56 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.348 0.594 . . . . 0.0 109.509 179.347 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.59 ' HA ' ' HE2' ' C' ' 109' ' ' TYR . 82.5 mttt -63.49 -17.74 63.07 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.443 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.25 22.82 12.65 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.563 179.03 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.697 HG21 ' O ' ' A' ' 29' ' ' TYR . 4.3 m -119.06 -14.72 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 121.838 -0.539 . . . . 0.0 111.964 179.745 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 10.7 pt-20 -75.43 -28.63 59.44 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.481 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.702 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -175.093 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.5 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 45.0 t . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 120.796 0.331 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -69.77 -35.73 75.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.486 178.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 47' ' ' SER . . . . . 0.709 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 32.8 m -69.99 -19.95 63.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.089 0.947 . . . . 0.0 108.63 177.159 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 48' ' ' LEU . . . . . 0.5 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 33.4 tp -72.29 -28.92 63.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 49' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 31.5 mmm-85 -61.26 -24.14 66.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.949 179.014 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 50' ' ' GLN . . . . . 0.709 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.1 mt-30 -72.67 -36.74 67.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.984 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 51' ' ' GLN . . . . . 0.517 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 98.9 mm-40 -70.45 -26.13 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.496 178.108 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.478 HG21 ' O ' ' B' ' 48' ' ' LEU . 57.7 t -74.73 -40.72 47.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.357 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.88 -33.75 74.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 54' ' ' ALA . . . . . 0.517 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -65.21 -55.04 20.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.916 178.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.53 -44.98 77.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.653 -179.099 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 56' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' B' ' 59' ' ' VAL . 24.1 pt20 -72.83 -24.94 60.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 57' ' ' GLY . . . . . 0.509 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.19 -30.9 73.95 Favored Glycine 0 C--O 1.237 0.302 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.687 ' HB3' HG21 ' C' ' 99' ' ' VAL . 14.1 mm100 -72.02 -41.75 67.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.168 -0.516 . . . . 0.0 109.933 178.433 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' B' ' 56' ' ' GLN . 2.9 t -65.42 -46.21 90.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.402 179.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 60' ' ' GLN . . . . . 0.509 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 8.9 pt20 -60.58 -43.01 97.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.762 -178.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 61' ' ' HIS . . . . . 0.477 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.1 p-80 -78.28 -16.82 57.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 62' ' ' LEU . . . . . 0.617 ' HG ' ' HE2' ' C' ' 106' ' ' PHE . 1.2 mp -77.56 -36.29 52.32 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.402 178.453 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.495 ' HG2' HD11 ' A' ' 22' ' ' LEU . 66.2 mt-30 -73.79 -31.49 63.3 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 64' ' ' ALA . . . . . 0.424 ' HB2' ' O ' ' B' ' 61' ' ' HIS . . . -57.1 -54.4 47.17 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.689 177.111 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 65' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' B' ' 69' ' ' TYR . . . -58.27 -47.12 84.61 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.3 178.413 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 66' ' ' PHE . . . . . 0.599 ' HE2' ' HG ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -47.58 -33.09 6.12 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 123.838 0.711 . . . . 0.0 112.682 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -54.58 -33.85 60.96 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 0.0 111.524 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -86.03 -12.22 50.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.912 0.387 . . . . 0.0 111.472 179.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 69' ' ' TYR . . . . . 0.722 ' O ' HG21 ' B' ' 72' ' ' VAL . 61.9 m-85 -104.05 -16.67 15.22 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.494 0.664 . . . . 0.0 109.327 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.584 ' HA ' ' HE2' ' A' ' 29' ' ' TYR . 83.5 mttt -62.85 -17.97 62.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.407 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.85 22.53 12.8 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.594 178.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 72' ' ' VAL . . . . . 0.722 HG21 ' O ' ' B' ' 69' ' ' TYR . 4.2 m -118.89 -14.4 9.22 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 O-C-N 121.871 -0.518 . . . . 0.0 112.028 179.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 73' ' ' GLU . . . . . 0.447 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 11.5 pt-20 -75.53 -28.55 59.14 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.43 ' N ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 -175.09 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 85' ' ' VAL . . . . . 0.527 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 47.2 t . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 109.962 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 86' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.86 -35.93 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.393 0.616 . . . . 0.0 109.678 178.831 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 87' ' ' SER . . . . . 0.717 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 44.5 m -70.9 -19.9 62.55 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.057 0.932 . . . . 0.0 108.966 177.265 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 88' ' ' LEU . . . . . 0.527 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 35.9 tp -71.83 -28.56 63.65 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.538 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 89' ' ' ARG . . . . . 0.572 ' HA ' ' CG1' ' C' ' 92' ' ' VAL . 26.2 mmm-85 -63.09 -22.82 67.12 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.041 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 90' ' ' GLN . . . . . 0.717 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.0 OUTLIER -73.77 -35.25 64.96 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.886 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' C' C ' 91' ' ' GLN . . . . . 0.428 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 99.0 mm-40 -70.98 -28.7 64.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.976 177.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 92' ' ' VAL . . . . . 0.572 ' CG1' ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -79.08 -31.49 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 119.982 -0.687 . . . . 0.0 110.359 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' C' C ' 93' ' ' GLU . . . . . 0.444 ' HA ' HE21 ' C' ' 96' ' ' GLN . 46.5 tp10 -63.37 -34.74 78.37 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.915 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 94' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -66.53 -52.43 45.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.244 -1.344 . . . . 0.0 111.256 178.294 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.79 -42.95 80.39 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.788 -1.096 . . . . 0.0 111.464 -179.257 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 96' ' ' GLN . . . . . 0.591 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 25.3 pt20 -74.8 -25.11 58.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.938 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 97' ' ' GLY . . . . . 0.554 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -68.23 -30.6 73.72 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 177.421 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 98' ' ' GLN . . . . . 0.55 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 14.6 mm100 -73.31 -43.12 61.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.934 -0.633 . . . . 0.0 110.495 178.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 99' ' ' VAL . . . . . 0.687 HG21 ' HB3' ' B' ' 58' ' ' GLN . 0.2 OUTLIER -71.52 -34.18 52.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.249 -179.399 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' C' C ' 100' ' ' GLN . . . . . 0.554 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.5 pt20 -65.32 -43.18 91.8 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.104 177.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 101' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' C' ' 104' ' ' ALA . 5.6 p-80 -78.5 -17.33 56.4 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.563 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 102' ' ' LEU . . . . . 0.622 HD21 ' HG2' ' A' ' 23' ' ' GLN . 4.0 mt -74.2 -37.82 63.8 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.367 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 103' ' ' GLN . . . . . 0.47 ' HG2' HD11 ' B' ' 62' ' ' LEU . 63.8 mt-30 -72.46 -31.78 65.71 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.584 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 104' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' C' ' 101' ' ' HIS . . . -57.28 -53.79 54.16 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.543 177.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 105' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' C' ' 109' ' ' TYR . . . -59.32 -46.44 88.57 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.556 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 106' ' ' PHE . . . . . 0.617 ' HE2' ' HG ' ' B' ' 62' ' ' LEU . 0.7 OUTLIER -48.19 -32.94 7.73 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.795 0.684 . . . . 0.0 112.119 179.502 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 38.8 t -53.47 -35.7 60.85 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.913 0.387 . . . . 0.0 111.314 -179.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -84.93 -12.95 52.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.894 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' C' C ' 109' ' ' TYR . . . . . 0.71 ' O ' HG21 ' C' ' 112' ' ' VAL . 62.8 m-85 -103.43 -16.18 15.67 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.633 0.73 . . . . 0.0 109.418 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 110' ' ' LYS . . . . . 0.591 ' HA ' ' HE2' ' B' ' 69' ' ' TYR . 82.7 mttt -62.69 -18.46 62.49 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.291 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.65 21.85 13.74 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.313 -0.955 . . . . 0.0 111.868 179.046 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 112' ' ' VAL . . . . . 0.71 HG21 ' O ' ' C' ' 109' ' ' TYR . 4.4 m -118.47 -13.57 10.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 O-C-N 121.893 -0.505 . . . . 0.0 112.285 179.469 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 113' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' C' ' 114' ' ' LEU . 10.6 pt-20 -76.85 -28.83 55.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' C' C ' 114' ' ' LEU . . . . . 0.468 ' N ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.79 0 CA-C-N 115.031 -0.986 . . . . 0.0 113.578 -175.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.989 0 N-CA-C 111.941 -0.463 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.606 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 98.2 mt -58.64 -57.88 23.33 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.043 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.606 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 75.2 Cg_exo -44.98 -46.19 13.34 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.794 2.329 . . . . 0.0 112.785 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.42 ' HA ' ' HB2' ' A' ' 7' ' ' SER . 38.8 t70 -62.61 -31.65 72.52 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.59 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.52 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 78.5 t -58.37 -55.7 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.59 -23.64 65.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.093 178.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 52.8 m -72.73 -21.26 61.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.571 0.7 . . . . 0.0 110.475 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.7 tp -76.56 -18.72 58.52 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 5.6 mpt_? -73.8 -40.21 63.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.564 178.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 7' ' ' SER . 4.0 pt20 -71.93 -30.35 65.24 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.579 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 37.4 tt0 -69.63 -28.62 66.06 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 122.116 0.96 . . . . 0.0 108.479 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 t -74.48 -32.73 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 114.273 -1.33 . . . . 0.0 109.444 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.643 ' HA ' HE21 ' A' ' 16' ' ' GLN . 51.0 mt-10 -71.31 -26.54 62.89 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.32 -41.19 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.477 177.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.549 HD13 ' HA ' ' B' ' 56' ' ' GLN . 37.3 tp -63.47 -38.42 91.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.385 -1.28 . . . . 0.0 110.107 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.643 HE21 ' HA ' ' A' ' 13' ' ' GLU . 26.2 pt20 -77.0 -21.27 54.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.844 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.858 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -71.36 -33.68 64.28 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.657 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 3.8 mm100 -70.65 -44.6 66.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.472 -0.364 . . . . 0.0 110.474 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.527 HG12 ' CD1' ' C' ' 95' ' ' LEU . 8.1 p -70.12 -31.69 48.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.734 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.858 HE21 ' HA2' ' A' ' 17' ' ' GLY . 19.2 pt20 -71.91 -38.73 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.4 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.657 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 12.0 p-80 -79.96 -18.0 51.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.197 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.695 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 1.8 mp -79.47 -28.81 41.55 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.55 ' HG2' HD13 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -76.97 -29.11 55.4 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 21' ' ' HIS . . . -60.01 -60.92 3.07 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.581 177.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.53 -41.4 94.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.542 178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.695 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.04 -28.12 56.1 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.898 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t -60.07 -31.96 70.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.226 0.536 . . . . 0.0 110.77 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -76.82 -48.16 19.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.586 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.715 ' HA ' HG21 ' A' ' 32' ' ' VAL . 34.5 m-85 -70.89 -15.55 62.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.537 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 37.2 ttmt -66.17 -40.64 90.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.21 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -97.98 32.41 2.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.738 0.78 . . . . 0.0 110.123 178.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.715 HG21 ' HA ' ' A' ' 29' ' ' TYR . 6.6 t -94.81 -36.41 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.265 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -101.89 103.75 14.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 122.493 1.14 . . . . 0.0 110.498 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.729 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -172.84 -27.23 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 112.566 -2.106 . . . . 0.0 108.991 -179.653 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.579 ' CD1' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -132.53 43.94 1.2 Allowed Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.487 176.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 39.5 Cg_endo -65.62 -179.21 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 122.486 2.124 . . . . 0.0 113.355 -179.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.96 162.71 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.432 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -179.3 164.48 32.64 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.014 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.04 -156.95 24.72 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.745 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.479 HG23 HD13 ' A' ' 40' ' ' ILE . 5.3 tt . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.324 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.756 -0.538 . . . . 0.0 111.756 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.605 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 99.2 mt -57.21 -58.08 20.43 Favored Pre-proline 0 N--CA 1.467 0.412 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.564 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.8 Cg_exo -45.64 -45.43 16.36 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 122.595 2.197 . . . . 0.0 112.773 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.423 ' HA ' ' HB2' ' B' ' 47' ' ' SER . 38.6 t70 -63.27 -30.89 71.94 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.377 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.523 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 70.7 t -58.84 -55.52 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.534 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.52 -23.97 65.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.158 178.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.683 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.9 m -72.21 -22.09 61.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.436 0.636 . . . . 0.0 110.526 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 23.4 tp -75.82 -18.51 59.45 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 5.4 mpt_? -74.1 -39.38 63.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.516 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.683 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.7 pt20 -72.42 -30.77 64.93 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.566 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.6 tt0 -69.14 -28.25 66.28 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.105 0.955 . . . . 0.0 108.518 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -75.32 -32.74 26.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 114.44 -1.254 . . . . 0.0 109.453 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.616 ' HA ' HE21 ' B' ' 56' ' ' GLN . 49.0 mt-10 -70.94 -26.39 63.17 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.92 -42.03 73.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.447 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.534 HD13 ' HA ' ' C' ' 96' ' ' GLN . 37.1 tp -63.07 -38.38 90.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.334 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.616 HE21 ' HA ' ' B' ' 53' ' ' GLU . 25.4 pt20 -76.95 -20.77 55.74 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.836 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.838 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -72.13 -33.64 62.02 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 177.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.636 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 3.5 mm100 -70.04 -44.75 68.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.954 0.407 . . . . 0.0 110.357 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.534 HG12 ' CD1' ' A' ' 15' ' ' LEU . 8.2 p -69.89 -32.12 50.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.891 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.838 HE21 ' HA2' ' B' ' 57' ' ' GLY . 17.6 pt20 -71.89 -38.77 69.93 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.347 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.636 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 11.3 p-80 -79.78 -17.68 52.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.41 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.715 ' O ' ' HB2' ' B' ' 66' ' ' PHE . 1.9 mp -79.93 -29.12 39.67 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.536 ' HG2' HD13 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -75.85 -29.22 58.49 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.322 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.567 ' HB2' ' O ' ' B' ' 61' ' ' HIS . . . -59.85 -61.66 2.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.627 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.53 89.78 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.66 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.715 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.94 -29.15 59.69 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.108 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.5 t -58.56 -34.06 70.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.004 0.366 . . . . 0.0 110.648 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.417 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 5.1 mm100 -75.21 -47.92 25.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.328 0.585 . . . . 0.0 109.9 178.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.725 ' HA ' HG21 ' B' ' 72' ' ' VAL . 33.9 m-85 -70.94 -16.13 62.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 37.1 ttmt -66.51 -39.98 88.97 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.443 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.401 ' O ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -98.23 31.39 2.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.684 0.754 . . . . 0.0 109.908 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.725 HG21 ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -93.82 -36.66 7.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.267 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.401 ' HB2' HG23 ' A' ' 32' ' ' VAL . 37.8 tt0 -102.25 101.86 12.19 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.532 1.158 . . . . 0.0 111.145 178.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.723 HD23 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER -170.55 -27.18 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 112.411 -2.177 . . . . 0.0 108.837 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.563 ' CD1' HD22 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -131.58 43.92 1.23 Allowed Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.454 176.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 39.0 Cg_endo -65.58 -179.19 1.13 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.254 1.969 . . . . 0.0 113.629 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -82.61 162.7 21.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.156 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.99 165.63 34.7 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.616 -0.802 . . . . 0.0 111.796 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.9 -156.61 25.57 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.201 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.434 HD13 HG23 ' B' ' 80' ' ' ILE . 5.2 tt . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.273 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.402 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.93 -0.468 . . . . 0.0 111.93 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.649 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 98.0 mt -59.62 -56.53 34.88 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 119.414 -0.326 . . . . 0.0 111.718 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.649 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 74.4 Cg_exo -46.34 -45.46 18.73 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 122.907 2.405 . . . . 0.0 112.818 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . 0.409 ' HA ' ' HB2' ' C' ' 87' ' ' SER . 35.8 t70 -62.53 -33.28 74.59 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.484 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.56 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 76.3 t -57.18 -55.81 18.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.55 -24.14 65.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.247 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.656 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 56.1 m -72.01 -22.02 61.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.539 0.685 . . . . 0.0 110.207 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.607 ' O ' HG13 ' C' ' 92' ' ' VAL . 25.6 tp -75.69 -19.12 59.34 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.574 ' O ' HG23 ' C' ' 92' ' ' VAL . 4.6 mpt_? -75.94 -36.94 59.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.313 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' C' ' 87' ' ' SER . 4.0 pt20 -73.26 -29.49 62.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.496 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.5 tt0 -69.77 -30.33 67.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 177.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.607 HG13 ' O ' ' C' ' 88' ' ' LEU . 16.0 m -75.85 -27.9 18.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.738 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.654 ' HA ' HE21 ' C' ' 96' ' ' GLN . 52.3 mt-10 -70.26 -28.17 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -70.11 -41.0 74.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.542 177.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.54 HD13 ' HA ' ' A' ' 16' ' ' GLN . 40.2 tp -63.77 -37.52 87.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.27 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.654 HE21 ' HA ' ' C' ' 93' ' ' GLU . 26.2 pt20 -77.69 -21.35 52.16 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.727 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.846 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -71.22 -34.07 64.51 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.658 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 3.1 mm100 -69.84 -44.87 69.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.317 178.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.53 HG12 ' CD1' ' B' ' 55' ' ' LEU . 10.0 p -70.22 -30.99 45.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.104 -0.639 . . . . 0.0 112.204 -178.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.846 HE21 ' HA2' ' C' ' 97' ' ' GLY . 19.2 pt20 -72.69 -38.86 67.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.001 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.658 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 12.3 p-80 -80.07 -17.16 53.41 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 119.448 -0.901 . . . . 0.0 110.21 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.614 ' O ' ' HB2' ' C' ' 106' ' ' PHE . 1.8 mp -79.79 -29.27 40.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.483 ' HG2' HD13 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -76.91 -28.83 55.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 176.359 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' C' ' 101' ' ' HIS . . . -59.84 -61.86 2.3 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.514 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.12 -41.5 88.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.648 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.614 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.01 -31.44 61.05 Favored 'General case' 0 C--O 1.204 -1.313 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.724 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.4 t -55.74 -34.62 65.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.902 0.382 . . . . 0.0 110.728 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -75.38 -49.11 20.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.302 0.572 . . . . 0.0 109.967 178.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.718 ' HA ' HG21 ' C' ' 112' ' ' VAL . 32.7 m-85 -70.36 -16.13 62.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.792 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.412 ' N ' ' O ' ' C' ' 106' ' ' PHE . 30.1 ttmt -69.32 -34.67 75.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.647 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.5 30.66 4.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.452 0.644 . . . . 0.0 109.582 177.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.718 HG21 ' HA ' ' C' ' 109' ' ' TYR . 5.2 t -93.47 -37.25 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.337 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.417 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 37.2 tt0 -101.45 102.71 13.55 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-O 122.404 1.097 . . . . 0.0 110.559 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.715 HD23 ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER -170.77 -28.56 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.792 -179.753 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.563 ' CD1' HD22 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -131.15 44.38 1.37 Allowed Pre-proline 0 CA--C 1.55 0.972 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.288 176.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 44.0 Cg_endo -66.33 179.36 2.04 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 122.233 1.956 . . . . 0.0 113.309 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -79.98 164.26 23.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.467 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 179.3 165.37 33.4 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.811 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 88.55 -160.8 30.6 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.157 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.471 HD13 HG23 ' C' ' 120' ' ' ILE . 4.9 tt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.45 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.458 ' O ' HG22 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.937 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.562 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 91.0 mt -60.0 -56.02 39.75 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.099 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.562 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 76.9 Cg_exo -42.41 -48.67 6.68 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 123.081 2.521 . . . . 0.0 113.179 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -57.7 -44.5 85.93 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.017 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 1' ' ' GLY . 93.5 t -61.58 -51.27 74.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.621 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.626 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.86 -27.34 68.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.511 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.684 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 75.2 m -67.7 -28.46 67.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.07 0.462 . . . . 0.0 109.847 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.2 tp -75.48 -21.66 57.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.622 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 39.0 mmm-85 -65.4 -21.53 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 7' ' ' SER . 6.6 mt-30 -73.39 -42.83 61.66 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -70.86 -29.29 65.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.782 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 9' ' ' ARG . 28.3 m -76.42 -40.87 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.634 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.82 -24.13 61.67 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -55.29 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.552 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.605 HD12 ' HA ' ' B' ' 56' ' ' GLN . 12.3 tp -58.92 -34.12 71.36 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.295 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HA ' HD22 ' C' ' 95' ' ' LEU . 15.4 tt0 -67.12 -38.31 85.37 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.484 179.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.489 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -61.4 -31.72 78.39 Favored Glycine 0 C--O 1.237 0.324 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.753 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.67 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 95.6 mm-40 -72.94 -49.95 26.37 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 16' ' ' GLN . 10.2 p -66.41 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.3 pt20 -68.88 -42.97 76.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.099 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.54 ' HA ' ' HB1' ' A' ' 24' ' ' ALA . 6.8 p-80 -75.81 -17.29 59.9 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.8 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' B' ' 63' ' ' GLN . 12.3 mt -73.57 -37.3 65.56 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 176.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.795 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.6 tm0? -70.65 -29.26 65.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.54 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -58.38 -62.13 2.07 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.086 178.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 -41.15 92.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.08 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.596 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -56.04 -28.98 59.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.12 -179.85 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.0 t -61.6 -31.88 71.96 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.028 0.442 . . . . 0.0 110.259 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -73.97 -52.04 14.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.59 0.71 . . . . 0.0 109.508 178.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.541 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 56.8 m-85 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.238 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.29 -41.1 98.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.851 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -96.36 29.67 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.49 0.662 . . . . 0.0 111.272 179.56 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 3.5 t -96.3 -41.12 11.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.594 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.483 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 19.3 tt0 -102.74 105.43 15.87 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.63 0.729 . . . . 0.0 109.833 177.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.66 ' H ' ' HD3' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -175.56 -31.43 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.36 -179.236 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.515 ' HE2' ' HA2' ' B' ' 78' ' ' GLY . 0.0 OUTLIER -121.62 19.06 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.66 ' HD3' ' H ' ' A' ' 34' ' ' LEU . 44.4 Cg_endo -86.87 -158.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.367 1.523 0 CA-C-N 121.684 1.637 . . . . 0.0 112.409 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -114.98 -152.27 0.5 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.997 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.525 ' HA2' ' HE2' ' C' ' 115' ' ' PHE . . . 143.72 -117.8 1.12 Allowed Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -82.78 -4.94 89.84 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.505 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.453 HG21 HD13 ' A' ' 40' ' ' ILE . 12.4 tt . . . . . 0 C--O 1.244 0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.792 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.451 ' O ' HG22 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.487 2.043 0 N-CA-C 111.926 -0.469 . . . . 0.0 111.926 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.566 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 91.8 mt -60.37 -56.37 35.97 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.229 -0.415 . . . . 0.0 111.431 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.6 Cg_exo -41.4 -49.26 5.06 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.169 2.58 . . . . 0.0 113.211 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.14 -46.02 83.05 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.451 HG22 ' O ' ' B' ' 41' ' ' GLY . 86.4 t -60.92 -50.81 79.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.593 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.24 -27.62 68.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.443 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 69.7 m -67.68 -27.89 67.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.011 0.434 . . . . 0.0 109.965 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.46 -21.56 58.0 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.574 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.604 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 39.5 mmm-85 -65.38 -21.97 66.74 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' B' ' 47' ' ' SER . 5.8 mt-30 -72.99 -42.09 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.623 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -71.85 -28.48 63.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.51 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.567 HG22 ' O ' ' B' ' 49' ' ' ARG . 30.4 m -77.06 -42.25 31.65 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.444 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.95 -25.3 63.57 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.13 -55.2 17.59 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' C' ' 96' ' ' GLN . 12.5 tp -59.27 -33.5 71.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.382 -1.281 . . . . 0.0 110.251 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.605 ' HA ' HD12 ' A' ' 15' ' ' LEU . 14.3 tt0 -67.15 -39.2 86.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.521 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.499 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -61.06 -31.72 77.72 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.766 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.688 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 96.0 mm-40 -72.76 -49.5 30.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.02 0.438 . . . . 0.0 111.114 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.467 HG11 ' O ' ' B' ' 56' ' ' GLN . 9.8 p -66.99 -32.18 56.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 8.0 pt20 -69.96 -42.87 72.6 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.986 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.545 ' HA ' ' HB1' ' B' ' 64' ' ' ALA . 6.8 p-80 -75.74 -17.29 59.96 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.671 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.735 HD21 ' HG2' ' C' ' 103' ' ' GLN . 12.0 mt -73.34 -37.11 66.22 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.75 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.2 tm0? -70.6 -29.98 66.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.545 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -57.39 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.068 178.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -40.99 88.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.134 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.603 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.2 OUTLIER -56.62 -28.7 61.06 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.225 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.1 t -62.0 -30.68 71.11 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.212 0.53 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 54.8 mt-30 -75.07 -51.21 14.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.584 0.706 . . . . 0.0 109.389 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.542 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 61.0 m-85 -66.28 -16.42 64.01 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.299 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.67 -41.79 98.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.879 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.483 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -95.83 29.42 2.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.362 0.601 . . . . 0.0 111.543 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' B' ' 69' ' ' TYR . 3.6 t -96.28 -40.24 10.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.457 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.47 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 19.1 tt0 -103.68 105.36 15.56 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 122.011 0.91 . . . . 0.0 109.922 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.679 ' N ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -175.63 -31.38 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.316 -179.316 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.553 ' HE2' ' HA2' ' C' ' 118' ' ' GLY . 0.0 OUTLIER -121.89 18.83 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 178.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.65 ' HD3' ' H ' ' B' ' 74' ' ' LEU . 41.9 Cg_endo -87.62 -159.53 0.09 OUTLIER 'Trans proline' 0 C--N 1.365 1.427 0 CA-C-N 121.52 1.579 . . . . 0.0 112.057 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -114.12 -151.85 0.49 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.1 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . 0.515 ' HA2' ' HE2' ' A' ' 35' ' ' PHE . . . 144.63 -115.29 0.85 Allowed Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.24 -5.87 84.94 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.527 -0.845 . . . . 0.0 111.218 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.418 HG21 HD13 ' B' ' 80' ' ' ILE . 10.4 tt . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.098 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.559 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 91.0 mt -56.91 -56.47 32.89 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.277 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.559 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 78.1 Cg_exo -42.41 -48.63 6.71 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 123.173 2.582 . . . . 0.0 113.226 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.49 -45.11 85.26 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.023 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 97.8 t -61.1 -51.95 67.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.793 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.42 -26.97 68.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.394 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 75.5 m -68.07 -28.32 67.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 0.0 109.956 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.36 -21.54 58.26 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.333 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 42.6 mmm-85 -63.92 -23.65 67.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.694 178.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' C' ' 87' ' ' SER . 5.8 mt-30 -72.48 -44.55 62.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.169 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -69.26 -27.46 65.45 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.788 0.804 . . . . 0.0 110.795 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.27 -45.11 35.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.525 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.4 -21.8 61.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -55.47 13.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.375 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.56 HD22 ' HA ' ' A' ' 16' ' ' GLN . 1.4 mt -56.46 -38.18 71.31 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.118 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.636 ' HA ' HD12 ' B' ' 55' ' ' LEU . 17.0 tt0 -64.23 -38.98 92.97 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.163 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.498 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.88 -31.65 79.12 Favored Glycine 0 C--O 1.238 0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.587 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.683 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 96.2 mm-40 -73.04 -50.04 25.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 111.189 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.401 HG11 ' O ' ' C' ' 96' ' ' GLN . 9.6 p -66.37 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.59 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 8.0 pt20 -68.94 -43.41 75.12 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.026 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.552 ' HA ' ' HB1' ' C' ' 104' ' ' ALA . 6.6 p-80 -75.53 -17.06 60.19 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.967 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.795 HD21 ' HG2' ' A' ' 23' ' ' GLN . 12.8 mt -74.25 -36.62 63.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.735 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.1 tm0? -70.94 -29.18 65.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.552 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -58.19 -63.07 1.39 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.829 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.39 -42.01 90.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.136 178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.622 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.2 OUTLIER -55.57 -29.1 58.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.174 -0.921 . . . . 0.0 112.308 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 10.6 t -61.98 -30.62 71.06 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.028 0.442 . . . . 0.0 110.653 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -75.56 -51.1 13.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.594 0.712 . . . . 0.0 109.401 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.655 ' HA ' HG12 ' C' ' 112' ' ' VAL . 58.7 m-85 -66.03 -17.38 64.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.016 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -60.76 -39.49 88.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.08 -0.963 . . . . 0.0 110.907 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.483 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.56 26.64 4.83 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.655 HG12 ' HA ' ' C' ' 109' ' ' TYR . 1.1 m -99.41 -30.58 3.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.816 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.483 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 18.4 tt0 -102.95 103.22 13.33 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 121.922 0.868 . . . . 0.0 109.566 176.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.671 ' N ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -176.17 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 113.399 -1.728 . . . . 0.0 110.329 -179.111 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.525 ' HE2' ' HA2' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -121.15 18.77 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.053 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.664 ' HD3' ' H ' ' C' ' 114' ' ' LEU . 60.6 Cg_endo -86.93 -159.2 0.09 OUTLIER 'Trans proline' 0 C--N 1.37 1.676 0 CA-C-N 121.504 1.573 . . . . 0.0 112.308 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -114.25 -149.4 0.45 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . 0.553 ' HA2' ' HE2' ' B' ' 75' ' ' PHE . . . 142.05 -115.6 0.99 Allowed Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.37 -6.41 83.97 Favored Glycine 0 N--CA 1.454 -0.149 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.567 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.481 HD13 HG21 ' C' ' 120' ' ' ILE . 11.5 tt . . . . . 0 C--O 1.245 0.858 0 CA-C-O 118.594 -0.717 . . . . 0.0 110.187 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.433 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.487 2.045 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.7 mp -56.7 -57.1 26.03 Favored Pre-proline 0 N--CA 1.464 0.271 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.575 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -42.28 -48.27 6.7 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 123.141 2.561 . . . . 0.0 113.459 -179.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -45.8 88.56 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.923 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.552 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 85.2 t -62.07 -36.33 73.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.257 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.28 -33.47 69.79 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.704 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -69.45 -20.25 63.76 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.416 1.103 . . . . 0.0 108.294 177.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.552 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 28.6 tp -76.3 -29.65 57.43 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.323 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.674 ' HA ' HG13 ' A' ' 12' ' ' VAL . 22.6 mmm-85 -66.37 -39.94 89.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.074 0.464 . . . . 0.0 109.997 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -69.76 -41.93 74.54 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.14 179.694 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.451 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 7.4 tt0 -66.62 -34.94 79.0 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.104 0.478 . . . . 0.0 111.377 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.674 HG13 ' HA ' ' A' ' 9' ' ' ARG . 5.7 p -76.97 -30.88 18.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' N ' HG12 ' A' ' 12' ' ' VAL . 37.2 tt0 -69.98 -30.56 67.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.47 -56.29 13.22 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.716 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.486 ' O ' HG21 ' A' ' 19' ' ' VAL . 28.2 tp -58.39 -34.52 70.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.054 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -65.27 -44.29 88.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.688 178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.52 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -61.13 -31.31 76.33 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.625 179.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.722 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 69.8 mt-30 -71.95 -43.71 64.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.898 0.38 . . . . 0.0 110.584 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.486 HG21 ' O ' ' A' ' 15' ' ' LEU . 58.2 t -67.52 -40.93 85.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.839 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.8 pt20 -61.98 -42.12 98.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.059 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.472 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.3 p-80 -79.78 -17.16 54.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.771 -0.772 . . . . 0.0 111.024 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.722 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 11.5 mt -71.64 -41.19 69.1 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.423 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 0.0 OUTLIER -70.82 -31.97 68.88 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.43 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.66 -55.43 34.98 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.755 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -61.89 -39.94 93.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.693 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -55.05 -29.67 57.97 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.381 179.43 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -49.83 -26.87 4.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.029 0.442 . . . . 0.0 111.122 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.418 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 4.9 mm100 -96.66 -42.82 7.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.921 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.607 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.1 m-85 -73.58 -20.4 60.63 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -178.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.458 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 51.5 mtmt -70.38 -26.95 63.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.78 0.324 . . . . 0.0 110.64 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.418 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.64 31.6 5.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.74 0.781 . . . . 0.0 109.738 178.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.607 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 2.9 t -93.38 -42.12 12.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.238 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -97.71 100.05 11.43 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 122.336 1.065 . . . . 0.0 110.687 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.538 HD23 ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -171.58 -29.14 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 112.742 -2.026 . . . . 0.0 109.615 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.718 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 43.0 m-85 -63.07 -56.68 26.03 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.988 178.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.718 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 86.2 Cg_endo -83.66 172.49 10.11 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.28 1.987 . . . . 0.0 111.684 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -137.63 73.76 1.45 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.979 0.418 . . . . 0.0 109.939 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.27 4.15 90.3 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.021 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 90.76 -95.18 2.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.401 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.0 mt . . . . . 0 C--O 1.243 0.749 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.583 178.586 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.478 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.878 0 N-CA-C 112.11 -0.396 . . . . 0.0 112.11 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 mp -57.68 -56.91 29.46 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 119.229 -0.415 . . . . 0.0 111.518 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -42.37 -48.9 6.51 Favored 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 123.443 2.762 . . . . 0.0 113.369 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -62.78 -45.09 94.3 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.023 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.526 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 99.9 t -63.3 -36.15 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.422 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.561 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -71.2 -33.74 70.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.722 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 48.3 m -69.51 -20.6 63.71 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 122.373 1.082 . . . . 0.0 108.611 176.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.526 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 28.7 tp -75.95 -30.04 58.52 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.033 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.656 ' HA ' HG13 ' B' ' 52' ' ' VAL . 22.6 mmm-85 -66.21 -39.12 89.39 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.158 0.504 . . . . 0.0 110.319 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.722 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -70.24 -42.65 71.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.016 179.851 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.454 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 7.5 tt0 -65.55 -35.58 81.26 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.455 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.656 HG13 ' HA ' ' B' ' 49' ' ' ARG . 5.4 p -76.52 -30.24 19.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.757 -178.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.419 ' N ' HG12 ' B' ' 52' ' ' VAL . 37.4 tt0 -70.86 -29.88 66.11 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -66.43 -56.3 11.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.454 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.491 ' O ' HG21 ' B' ' 59' ' ' VAL . 27.3 tp -58.0 -34.47 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.039 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -65.21 -45.09 86.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.571 179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.487 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -60.07 -31.91 74.24 Favored Glycine 0 C--O 1.236 0.26 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.605 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.727 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.8 mt-30 -71.3 -44.01 65.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 110.681 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.491 HG21 ' O ' ' B' ' 55' ' ' LEU . 59.0 t -67.35 -40.18 84.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.7 pt20 -63.2 -41.95 99.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.339 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.468 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.99 -18.11 54.23 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.676 -0.809 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 11.4 mt -71.14 -40.33 71.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.43 ' HG2' HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -71.8 -31.77 66.91 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.7 -55.41 35.19 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.847 177.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.473 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -61.88 -40.91 97.02 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.636 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -54.73 -29.12 52.66 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.573 179.306 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.8 t -50.35 -27.76 6.81 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 111.109 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.456 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 4.3 mm100 -95.41 -42.47 8.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.893 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.618 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 15.2 m-85 -74.06 -19.49 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.527 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 51.7 mtmt -71.11 -26.62 63.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.612 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.456 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -106.69 31.57 5.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.682 0.753 . . . . 0.0 109.666 178.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.618 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 3.0 t -93.44 -42.51 13.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.991 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -96.86 100.7 12.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.229 1.014 . . . . 0.0 110.846 178.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.548 HD23 ' N ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -172.57 -30.29 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 112.653 -2.067 . . . . 0.0 109.795 179.727 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.724 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 39.2 m-85 -62.3 -55.63 38.23 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 177.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.724 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 89.1 Cg_endo -85.18 170.62 9.46 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.37 2.047 . . . . 0.0 111.442 179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -135.87 74.19 1.5 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.96 0.41 . . . . 0.0 110.227 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.36 6.13 89.49 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.98 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.75 -95.45 2.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.635 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.03 -0.986 . . . . 0.0 111.133 178.972 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.425 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.935 0 N-CA-C 112.049 -0.42 . . . . 0.0 112.049 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . . . . . . . . . 9.1 mp -56.1 -56.36 31.75 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.772 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -43.68 -46.97 10.0 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 123.119 2.546 . . . . 0.0 113.391 -178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.52 -45.13 88.58 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.137 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.577 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 96.0 t -63.02 -36.35 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.143 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.57 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.25 -34.52 70.83 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.2 m -69.23 -20.79 63.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.264 1.031 . . . . 0.0 108.312 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.615 ' O ' HG23 ' C' ' 92' ' ' VAL . 30.2 tp -74.64 -31.7 62.05 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.991 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.622 ' O ' HG22 ' C' ' 92' ' ' VAL . 23.5 mmm-85 -64.87 -40.15 94.69 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.663 0.602 . . . . 0.0 110.524 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.83 -42.0 82.14 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.47 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 7.8 tt0 -64.76 -37.05 86.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.077 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.622 HG22 ' O ' ' C' ' 89' ' ' ARG . 0.0 OUTLIER -70.79 -38.82 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.603 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.35 -31.13 71.72 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -67.1 -57.54 6.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.792 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.502 ' O ' HG21 ' C' ' 99' ' ' VAL . 26.7 tp -57.83 -34.69 69.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.297 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -65.23 -44.83 86.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.489 179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.422 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.21 -31.55 73.73 Favored Glycine 0 C--O 1.238 0.388 0 N-CA-C 111.629 -0.588 . . . . 0.0 111.629 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.721 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 71.9 mt-30 -72.52 -43.65 63.27 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.643 -0.328 . . . . 0.0 110.532 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.502 HG21 ' O ' ' C' ' 95' ' ' LEU . 59.6 t -67.63 -40.11 83.49 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.422 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 3.7 pt20 -62.87 -42.37 99.74 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.313 -0.155 . . . . 0.0 111.12 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.503 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 6.6 p-80 -79.24 -17.32 54.99 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.966 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 11.0 mt -71.51 -40.73 69.96 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 177.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.438 ' HG2' HD23 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.19 -32.27 68.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.54 -54.95 41.01 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.936 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.477 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -62.28 -40.34 95.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.554 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.525 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -54.89 -29.32 55.47 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.473 179.028 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.8 t -49.64 -27.19 4.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.91 0.386 . . . . 0.0 111.298 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 4.4 mm100 -96.16 -43.31 7.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.924 178.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.594 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -73.38 -20.36 60.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.525 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 49.8 mtmt -70.74 -25.8 63.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.675 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.505 ' HA ' HD22 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -108.48 32.8 4.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.823 0.82 . . . . 0.0 109.516 178.147 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.594 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 3.0 t -93.79 -42.87 13.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.861 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.495 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 32.3 tt0 -96.73 99.55 11.14 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.35 1.072 . . . . 0.0 111.149 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.505 HD22 ' HA ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER -169.95 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 112.523 -2.126 . . . . 0.0 109.397 -179.731 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.727 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 41.2 m-85 -59.98 -57.51 26.23 Favored Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.214 178.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.727 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 90.2 Cg_endo -84.2 170.85 10.58 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.231 1.954 . . . . 0.0 111.829 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -136.04 73.5 1.46 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.97 0.414 . . . . 0.0 110.129 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.39 5.54 89.48 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.983 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 89.22 -94.69 2.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 18.9 mt . . . . . 0 C--O 1.243 0.761 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.289 179.031 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.49 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.834 0 N-CA-C 112.373 -0.291 . . . . 0.0 112.373 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.532 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 3.5 mm? -52.48 -56.83 18.95 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 8.3 Cg_endo -51.81 -37.42 65.61 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.229 2.619 . . . . 0.0 112.463 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -73.92 -7.15 51.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.549 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 1' ' ' GLY . 84.0 t -86.63 -42.06 15.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.753 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.88 -27.97 62.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.606 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.678 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 57.1 p -72.64 -19.63 61.41 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.439 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 57.9 tp -78.96 -24.13 44.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.354 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.753 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -65.82 -47.69 74.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.678 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.6 OUTLIER -65.37 -42.19 92.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.95 179.54 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -62.04 -34.32 76.02 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.374 0.607 . . . . 0.0 110.141 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.46 -31.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.299 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 51.5 mt-10 -66.88 -30.41 70.57 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -53.1 27.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.316 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.528 ' O ' HG21 ' A' ' 19' ' ' VAL . 74.7 mt -58.8 -34.21 71.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.151 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.63 -46.86 74.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.502 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.507 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.06 -31.9 74.2 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.54 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.725 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.0 mt-30 -71.3 -46.88 59.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.839 0.352 . . . . 0.0 110.745 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.528 HG21 ' O ' ' A' ' 15' ' ' LEU . 89.5 t -64.46 -42.36 95.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.4 pt20 -62.36 -42.71 99.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.391 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.436 ' HD1' ' HA ' ' A' ' 18' ' ' GLN . 4.6 p-80 -78.01 -16.65 57.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.966 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.725 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.2 mt -72.0 -41.96 66.99 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.639 ' HG2' HD22 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -66.4 -36.12 82.04 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.369 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.46 -54.9 40.31 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.887 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.422 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -60.05 -41.86 93.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.367 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.487 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 4.3 m-85 -53.7 -32.17 50.85 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.646 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.9 t -49.71 -30.53 9.44 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.417 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 13.3 mm100 -91.62 -42.24 10.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.603 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.527 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 38.6 m-85 -73.33 -20.42 60.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.968 0.413 . . . . 0.0 111.37 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.529 ' HD2' ' O ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -63.23 -32.85 74.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.265 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.55 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -104.14 23.91 12.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.396 0.617 . . . . 0.0 110.548 178.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.566 HG12 ' CG1' ' B' ' 72' ' ' VAL . 0.9 OUTLIER -93.74 -23.34 5.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.589 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.481 ' O ' ' HD1' ' A' ' 35' ' ' PHE . 72.8 tt0 -81.22 -126.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.55 HD11 ' HA ' ' A' ' 31' ' ' LYS . 3.0 mt 62.45 -75.42 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.677 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 5.7 m-85 -53.7 -59.27 10.03 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.494 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.677 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 63.4 Cg_endo -78.13 176.12 10.33 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.953 1.769 . . . . 0.0 112.639 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -102.96 -89.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.476 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.44 ' HA3' ' HD3' ' C' ' 111' ' ' LYS . . . 103.36 18.38 14.89 Favored Glycine 0 C--N 1.329 0.191 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.632 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -107.06 -54.54 0.66 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.94 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.2 tt . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.191 179.548 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.485 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.983 0 N-CA-C 112.781 -0.128 . . . . 0.0 112.781 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.541 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 3.5 mm? -52.13 -56.69 19.61 Favored Pre-proline 0 N--CA 1.473 0.697 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 9.2 Cg_endo -52.05 -37.11 67.75 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.21 2.607 . . . . 0.0 112.505 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -74.13 -8.07 54.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.489 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 41' ' ' GLY . 86.8 t -85.7 -41.99 15.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.769 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.88 -27.1 61.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.882 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.676 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 49.6 p -73.92 -19.18 60.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 56.3 tp -78.89 -22.93 45.21 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.239 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.769 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -67.07 -47.66 70.61 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.676 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.7 OUTLIER -64.88 -43.07 94.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.774 179.326 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.23 -34.42 75.09 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.609 0.719 . . . . 0.0 110.395 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -78.08 -30.42 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.366 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 51.6 mt-10 -68.06 -29.52 68.51 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.08 21.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.9 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.52 ' O ' HG21 ' B' ' 59' ' ' VAL . 77.8 mt -58.56 -34.03 70.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.194 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -67.02 -46.89 73.1 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.655 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.532 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.89 -32.05 73.86 Favored Glycine 0 C--O 1.236 0.269 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.478 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.714 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 74.5 mt-30 -70.96 -47.55 58.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.764 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.52 HG21 ' O ' ' B' ' 55' ' ' LEU . 94.9 t -64.11 -41.85 93.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.532 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.5 pt20 -62.51 -43.31 99.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.443 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -77.31 -16.67 58.84 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.1 mt -72.01 -41.97 66.94 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.637 ' HG2' HD22 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.38 -36.48 82.96 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.615 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.17 -55.42 33.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.665 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.421 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -59.25 -42.07 90.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.51 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.448 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 4.3 m-85 -53.86 -32.7 53.99 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.658 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 47.7 t -48.17 -32.91 7.64 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.068 0.461 . . . . 0.0 111.054 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.422 ' O ' ' HE3' ' B' ' 71' ' ' LYS . 12.8 mm100 -89.63 -41.86 11.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.871 0.367 . . . . 0.0 111.894 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.527 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 41.0 m-85 -72.76 -21.8 60.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.548 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.491 ' HD2' ' O ' ' B' ' 70' ' ' LYS . 0.4 OUTLIER -62.36 -33.63 75.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.187 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.526 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -103.47 23.61 12.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.465 0.65 . . . . 0.0 110.544 178.399 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.566 ' CG1' HG12 ' A' ' 32' ' ' VAL . 1.0 OUTLIER -93.27 -23.29 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.485 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.496 ' O ' ' HD1' ' B' ' 75' ' ' PHE . 71.9 tt0 -81.28 -127.01 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.526 HD11 ' HA ' ' B' ' 71' ' ' LYS . 2.7 mt 62.07 -74.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 176.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.665 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 3.5 m-85 -54.24 -58.14 15.14 Favored Pre-proline 0 C--N 1.316 -0.857 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.647 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.665 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 66.5 Cg_endo -78.76 175.44 10.99 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.991 1.794 . . . . 0.0 112.726 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -102.57 -89.39 0.38 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . 0.461 ' HA3' ' HD3' ' A' ' 31' ' ' LYS . . . 103.94 18.79 12.95 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.865 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.66 -55.56 0.62 Allowed Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.788 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.8 tt . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.165 179.447 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.507 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.844 0 CA-C-O 120.508 -0.051 . . . . 0.0 113.182 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.525 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 3.5 mm? -51.77 -56.76 18.42 Favored Pre-proline 0 N--CA 1.468 0.425 0 C-N-CA 123.218 0.607 . . . . 0.0 112.618 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.525 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 6.9 Cg_endo -51.14 -39.45 61.15 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 123.37 2.714 . . . . 0.0 112.254 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -71.56 -10.63 60.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.517 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.507 HG23 ' O ' ' C' ' 81' ' ' GLY . 86.4 t -83.46 -42.28 17.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.78 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -73.1 -27.34 61.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.855 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.661 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 53.8 p -73.13 -19.26 61.17 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.444 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 55.8 tp -79.19 -23.22 43.99 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.468 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.78 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.6 OUTLIER -66.67 -47.67 71.74 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.661 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.6 OUTLIER -65.23 -42.9 92.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.85 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -61.2 -34.94 75.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.5 0.667 . . . . 0.0 110.249 179.096 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.14 -30.88 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.389 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 53.0 mt-10 -68.1 -30.54 69.74 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.39 -53.1 32.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.172 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.522 ' O ' HG21 ' C' ' 99' ' ' VAL . 70.9 mt -59.02 -34.04 71.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.214 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -67.02 -46.68 73.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.691 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.512 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -60.08 -32.12 74.94 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.714 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 74.6 mt-30 -70.78 -47.58 58.8 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 120.886 0.374 . . . . 0.0 110.775 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.522 HG21 ' O ' ' C' ' 95' ' ' LEU . 87.8 t -64.01 -41.68 93.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 2.5 pt20 -63.16 -42.38 99.41 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.442 ' HD1' ' HA ' ' C' ' 98' ' ' GLN . 5.1 p-80 -78.14 -16.99 57.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.809 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 10.5 mt -71.35 -41.51 69.67 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.645 ' HG2' HD22 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -66.65 -36.8 83.43 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.68 -54.7 41.01 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.665 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.61 -42.07 96.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.393 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.501 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 4.4 m-85 -53.73 -31.75 49.48 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.655 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.5 t -49.77 -32.19 13.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.413 ' O ' ' HE3' ' C' ' 111' ' ' LYS . 13.1 mm100 -89.47 -43.16 11.04 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.642 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.894 ' HA ' HG11 ' C' ' 112' ' ' VAL . 38.0 m-85 -72.7 -20.76 61.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 111.409 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HD2' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -62.48 -29.54 70.61 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.44 ' HD3' ' HA3' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -106.22 19.88 19.83 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.074 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.894 HG11 ' HA ' ' C' ' 109' ' ' TYR . 34.7 m -92.17 -19.14 7.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.312 177.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.556 ' O ' ' HD2' ' C' ' 116' ' ' PRO . 65.7 tt0 -76.46 -124.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 59.88 -84.85 0.02 OUTLIER 'General case' 0 C--N 1.338 0.098 0 CA-C-O 121.765 0.793 . . . . 0.0 112.6 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.689 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 2.8 m-85 -46.17 -60.7 3.26 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 113.588 -1.642 . . . . 0.0 113.432 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.689 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 70.3 Cg_endo -77.55 175.36 11.36 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.113 1.875 . . . . 0.0 112.847 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -102.74 -89.07 0.39 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.273 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . 0.407 ' HA3' ' HD3' ' B' ' 71' ' ' LYS . . . 103.36 17.95 16.15 Favored Glycine 0 C--N 1.329 0.194 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.593 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.12 -56.83 0.65 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.724 -0.751 . . . . 0.0 111.801 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 8.5 tt . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.251 -0.88 . . . . 0.0 109.842 179.36 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.41 ' O ' HG22 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.851 -0.499 . . . . 0.0 111.851 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.441 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 6.9 mp -55.45 -55.41 40.3 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.69 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.441 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 50.6 Cg_exo -44.88 -43.29 15.24 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.94 2.427 . . . . 0.0 112.768 -179.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -62.92 -39.69 95.33 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.022 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 1' ' ' GLY . 60.3 t -59.67 -46.05 93.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.896 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.72 -26.67 62.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.967 0.413 . . . . 0.0 110.551 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.547 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 65.1 m -70.89 -19.29 62.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.851 0.834 . . . . 0.0 108.995 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.569 HD13 HG11 ' B' ' 52' ' ' VAL . 67.6 tp -76.64 -23.69 53.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.781 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.65 ' O ' HG13 ' A' ' 12' ' ' VAL . 1.6 mmt85 -67.98 -32.63 73.18 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -70.87 -47.82 57.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.734 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.506 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 39.5 tt0 -63.25 -32.36 73.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.838 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.65 HG13 ' O ' ' A' ' 9' ' ' ARG . 1.1 p -77.02 -32.52 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.109 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 44.0 mt-10 -70.78 -27.36 63.86 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -68.81 -53.69 20.17 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.48 -1.237 . . . . 0.0 109.288 178.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.564 HD13 ' HB2' ' B' ' 56' ' ' GLN . 77.0 mt -57.62 -33.33 68.13 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.384 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.553 ' HB2' HD13 ' C' ' 95' ' ' LEU . 17.8 tt0 -69.75 -44.35 70.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.8 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -60.99 -31.52 76.78 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.612 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.72 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -73.77 -46.83 43.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.4 p -69.86 -31.09 46.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.749 -178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -71.42 -40.47 70.42 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.171 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.548 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.1 p-80 -79.77 -18.65 50.53 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.888 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.72 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.5 mt -73.37 -39.45 65.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.675 ' HG3' HD13 ' C' ' 102' ' ' LEU . 37.5 tt0 -65.99 -41.36 91.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.326 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.67 -46.79 74.1 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.263 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -63.81 -38.13 89.95 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.876 -1.057 . . . . 0.0 110.437 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.736 ' HB3' ' HG3' ' A' ' 30' ' ' LYS . 3.8 m-85 -59.24 -20.52 54.82 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.7 t -55.31 -23.68 24.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.099 0.476 . . . . 0.0 110.589 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.501 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 4.8 mm100 -107.83 -20.85 13.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.015 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.622 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 27.8 m-85 -96.08 -17.25 21.05 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.736 ' HG3' ' HB3' ' A' ' 26' ' ' PHE . 73.6 mttt -68.42 -29.83 68.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.829 0.347 . . . . 0.0 110.351 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.622 ' O ' HD22 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -102.32 26.71 7.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.057 0.456 . . . . 0.0 110.303 178.222 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.622 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 5.1 t -87.37 -42.87 15.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.464 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.516 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 10.6 tt0 -99.86 105.35 17.09 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.224 1.012 . . . . 0.0 111.075 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.866 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -177.71 -36.22 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.471 0 CA-C-N 112.718 -2.037 . . . . 0.0 110.618 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.627 ' H ' ' HD3' ' A' ' 36' ' ' PRO . 0.2 OUTLIER -121.82 -0.3 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.233 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 179.563 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.627 ' HD3' ' H ' ' A' ' 35' ' ' PHE . 31.9 Cg_exo -65.51 -172.39 0.24 Allowed 'Trans proline' 0 C--N 1.371 1.749 0 CA-C-N 122.468 1.917 . . . . 0.0 114.268 -178.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.425 ' OD1' ' HA ' ' C' ' 116' ' ' PRO . 17.7 p-10 -100.32 -161.79 0.89 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.955 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 144.86 -157.19 27.22 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.092 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -110.63 66.61 0.23 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.529 -0.844 . . . . 0.0 111.776 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.723 -179.368 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.815 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.466 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 6.8 mp -55.96 -55.6 39.56 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-O 119.11 -0.471 . . . . 0.0 112.026 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.466 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 53.6 Cg_exo -44.45 -43.78 13.71 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.735 2.29 . . . . 0.0 112.77 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -62.41 -39.66 94.0 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.066 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.414 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 57.4 t -59.94 -45.49 95.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.992 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.61 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.21 -26.11 61.91 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.53 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.532 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.6 m -71.09 -18.94 62.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.873 0.844 . . . . 0.0 108.982 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.518 HD13 HG11 ' C' ' 92' ' ' VAL . 69.8 tp -76.98 -23.76 52.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.877 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.631 ' O ' HG13 ' B' ' 52' ' ' VAL . 1.7 mmt85 -67.99 -32.57 73.06 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.1 OUTLIER -70.84 -49.11 49.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.747 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.535 ' O ' ' HG ' ' B' ' 55' ' ' LEU . 39.7 tt0 -62.42 -31.69 72.43 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.631 HG13 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -77.56 -32.35 18.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.265 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 44.1 mt-10 -70.9 -27.67 63.96 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -68.35 -53.98 20.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.258 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 78.5 mt -57.87 -32.6 67.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.372 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.564 ' HB2' HD13 ' A' ' 15' ' ' LEU . 16.7 tt0 -70.41 -44.83 67.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.688 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . . . . . . . . . . . -61.0 -31.12 75.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.476 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.74 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.5 OUTLIER -73.72 -46.56 45.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.729 0.3 . . . . 0.0 111.489 179.37 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.422 HG12 ' O ' ' B' ' 56' ' ' GLN . 13.2 p -70.21 -30.94 45.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.641 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 19.1 pt20 -71.42 -40.86 70.18 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.528 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.0 p-80 -79.34 -19.11 51.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.656 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.74 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.9 mt -73.25 -39.72 65.2 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.588 ' HG3' HD23 ' A' ' 22' ' ' LEU . 37.7 tt0 -65.35 -42.18 93.1 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.1 -46.75 72.17 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.46 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.551 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.393 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.751 ' HB3' ' HG3' ' B' ' 70' ' ' LYS . 3.6 m-85 -58.49 -20.91 49.52 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 39.9 t -54.12 -25.61 23.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.054 0.454 . . . . 0.0 110.495 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.529 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 4.5 mm100 -106.51 -20.91 13.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.2 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.613 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 26.7 m-85 -95.75 -17.56 21.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.751 ' HG3' ' HB3' ' B' ' 66' ' ' PHE . 73.4 mttt -68.27 -30.24 69.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.076 0.465 . . . . 0.0 110.632 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.636 ' O ' HD22 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -101.88 26.61 7.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.298 0.571 . . . . 0.0 110.465 178.426 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.613 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 5.0 t -87.63 -42.44 15.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.645 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.501 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 12.4 tt0 -100.62 103.66 14.96 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 122.13 0.967 . . . . 0.0 111.339 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.857 ' N ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -176.28 -33.13 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 112.68 -2.055 . . . . 0.0 110.822 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.652 ' H ' ' HD3' ' B' ' 76' ' ' PRO . 0.1 OUTLIER -124.47 0.32 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.164 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.652 ' HD3' ' H ' ' B' ' 75' ' ' PHE . 37.6 Cg_exo -65.63 -172.11 0.23 Allowed 'Trans proline' 0 C--N 1.369 1.63 0 CA-C-N 122.372 1.883 . . . . 0.0 114.476 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . 0.506 ' OD1' ' HA ' ' A' ' 36' ' ' PRO . 17.1 p-10 -100.47 -161.35 0.86 Allowed 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 114.358 -1.292 . . . . 0.0 110.997 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.61 -160.43 27.68 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.037 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -108.66 69.14 0.21 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.248 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 7.9 tp . . . . . 0 C--O 1.244 0.796 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.602 -179.63 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.403 ' O ' HG22 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.852 0 N-CA-C 111.838 -0.505 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.445 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 6.8 mp -56.54 -54.98 47.68 Favored Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 117.014 0.407 . . . . 0.0 111.656 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.445 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 51.5 Cg_exo -44.44 -42.95 14.02 Favored 'Trans proline' 0 C--N 1.363 1.308 0 C-N-CA 122.712 2.275 . . . . 0.0 112.881 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -63.85 -40.04 95.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.027 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.403 HG22 ' O ' ' C' ' 81' ' ' GLY . 64.8 t -58.95 -46.72 91.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.916 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.594 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.51 -26.05 62.51 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.001 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.547 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 67.2 m -71.82 -18.5 62.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.893 0.854 . . . . 0.0 108.849 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.543 HD13 HG11 ' A' ' 12' ' ' VAL . 65.6 tp -77.08 -23.25 51.93 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.634 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.658 ' O ' HG13 ' C' ' 92' ' ' VAL . 1.9 mmt85 -67.99 -32.51 72.96 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.547 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -71.29 -48.14 52.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.026 179.676 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.525 ' O ' ' HG ' ' C' ' 95' ' ' LEU . 38.7 tt0 -63.3 -31.77 73.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.583 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.658 HG13 ' O ' ' C' ' 89' ' ' ARG . 1.1 p -77.29 -32.7 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.263 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 43.9 mt-10 -70.95 -26.26 63.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.424 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -69.2 -53.79 18.14 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.173 178.15 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.553 HD13 ' HB2' ' A' ' 16' ' ' GLN . 75.5 mt -57.91 -32.77 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.423 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.527 ' HB2' HD23 ' B' ' 55' ' ' LEU . 16.9 tt0 -69.68 -44.84 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.623 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.469 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.61 -31.3 74.51 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.748 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.619 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 0.5 OUTLIER -74.72 -44.94 47.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.692 0.282 . . . . 0.0 111.509 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.431 HG12 ' O ' ' C' ' 96' ' ' GLN . 13.5 p -71.34 -30.51 40.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.453 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.469 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.2 pt20 -71.64 -42.2 67.89 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.157 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.619 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 10.5 p-80 -77.48 -19.03 56.54 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.902 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.675 HD13 ' HG3' ' A' ' 23' ' ' GLN . 1.5 mp -73.89 -39.45 63.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.558 ' HG3' HD23 ' B' ' 62' ' ' LEU . 38.2 tt0 -66.62 -41.46 88.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.03 71.72 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.421 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.552 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -63.33 -39.07 93.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.455 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.725 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 3.5 m-85 -58.58 -20.28 45.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.4 t -54.6 -25.67 27.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.212 0.529 . . . . 0.0 110.245 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.516 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 4.7 mm100 -105.54 -22.82 12.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.085 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.619 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 25.8 m-85 -93.75 -17.83 22.73 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.725 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 74.2 mttt -68.01 -28.54 67.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.021 0.439 . . . . 0.0 110.619 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.638 ' O ' HD22 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -104.05 26.52 8.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.223 0.535 . . . . 0.0 110.327 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.619 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 4.6 t -87.09 -42.66 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.214 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.529 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 7.4 tt0 -99.95 104.77 16.42 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 122.043 0.925 . . . . 0.0 111.342 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.816 ' N ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -177.74 -33.81 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 112.964 -1.926 . . . . 0.0 111.034 -179.648 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.656 ' H ' ' HD3' ' C' ' 116' ' ' PRO . 0.1 OUTLIER -124.09 0.6 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.167 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.656 ' HD3' ' H ' ' C' ' 115' ' ' PHE . 42.2 Cg_exo -65.52 -168.46 0.12 Allowed 'Trans proline' 0 C--N 1.37 1.675 0 CA-C-N 122.337 1.871 . . . . 0.0 114.183 -178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . 0.472 ' OD1' ' HA ' ' B' ' 76' ' ' PRO . 17.1 p-10 -104.62 -162.13 0.87 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.856 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 146.19 -155.53 26.56 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -113.72 67.09 0.26 Allowed Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.516 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.463 -0.779 . . . . 0.0 110.424 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.429 ' O ' HG21 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 2.01 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.513 ' HB3' ' HD3' ' A' ' 3' ' ' PRO . 2.3 tm? -63.82 -53.11 52.51 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 122.756 0.422 . . . . 0.0 110.787 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' A' ' 2' ' ' LEU . 71.6 Cg_exo -43.89 -44.97 11.69 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.914 2.41 . . . . 0.0 113.213 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.45 -32.18 73.55 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.938 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.47 HG22 HG11 ' B' ' 45' ' ' VAL . 82.7 t -63.01 -44.18 99.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.064 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -66.68 -37.52 84.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.785 0.326 . . . . 0.0 110.521 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.71 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 41.1 m -63.32 -26.35 68.72 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.834 0.826 . . . . 0.0 109.154 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.782 ' O ' HG22 ' A' ' 12' ' ' VAL . 62.5 tp -74.21 -39.87 62.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.255 178.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.654 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -55.86 -44.4 78.03 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.71 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -63.8 -42.15 97.76 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.757 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.509 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 36.7 tt0 -63.22 -34.8 78.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.989 0.423 . . . . 0.0 110.738 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.782 HG22 ' O ' ' A' ' 8' ' ' LEU . 54.5 t -70.07 -40.63 78.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.577 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 32.5 tt0 -63.3 -32.02 73.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -64.49 -61.42 2.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.549 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.443 HD13 ' HB2' ' B' ' 56' ' ' GLN . 2.7 mm? -60.27 -31.41 70.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.485 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.487 ' HB2' HD13 ' C' ' 95' ' ' LEU . 14.4 pt20 -74.16 -28.61 61.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -67.0 -33.55 84.16 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.703 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.9 mm100 -71.09 -50.5 33.1 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.334 -0.433 . . . . 0.0 111.102 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.8 -33.52 63.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.362 -0.535 . . . . 0.0 111.995 -179.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -66.11 -43.17 87.99 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.96 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -76.97 -19.71 56.99 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.208 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.703 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 24.6 mt -71.01 -42.72 69.22 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.8 tm0? -70.19 -33.49 71.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.89 -62.46 1.73 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.48 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.85 -42.61 98.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.863 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.667 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -57.0 -25.98 59.45 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.705 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -53.75 -28.59 35.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.267 0.556 . . . . 0.0 110.207 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.584 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 14.1 mt-30 -90.75 -50.29 5.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.893 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HA ' HG22 ' A' ' 32' ' ' VAL . 19.5 m-85 -66.58 -17.81 65.02 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -70.86 -20.71 62.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 110.782 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.25 35.52 3.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.592 0.71 . . . . 0.0 109.495 178.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.673 HG22 ' HA ' ' A' ' 29' ' ' TYR . 15.5 t -98.65 -35.64 5.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.805 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.53 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 40.3 tt0 -88.19 89.76 8.12 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 122.861 1.315 . . . . 0.0 110.934 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.2 OUTLIER -167.92 -36.66 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 111.983 -2.371 . . . . 0.0 109.068 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.695 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 59.2 m-85 -56.51 -55.55 41.56 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.291 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.695 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 93.3 Cg_endo -82.73 178.61 5.93 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.248 1.965 . . . . 0.0 111.241 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -89.3 -55.75 3.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.749 0.309 . . . . 0.0 111.47 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.66 -108.58 3.07 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.845 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.78 -63.98 4.38 Favored Glycine 0 C--N 1.328 0.094 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.676 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.73 -0.652 . . . . 0.0 111.143 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.434 ' O ' HG21 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.524 ' HB3' ' HD3' ' B' ' 43' ' ' PRO . 2.4 tm? -63.79 -53.32 51.03 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.733 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.524 ' HD3' ' HB3' ' B' ' 42' ' ' LEU . 77.2 Cg_exo -43.67 -45.34 10.91 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 122.626 2.217 . . . . 0.0 113.242 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.06 -31.03 72.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.232 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.47 HG11 HG22 ' A' ' 5' ' ' VAL . 83.7 t -64.05 -44.43 97.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.942 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.65 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.34 -38.38 87.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.664 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.0 m -63.8 -23.91 67.55 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.803 0.811 . . . . 0.0 109.548 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.791 ' O ' HG22 ' B' ' 52' ' ' VAL . 65.0 tp -76.04 -39.35 55.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.65 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -56.01 -44.2 78.45 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.664 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -64.21 -42.88 96.41 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.565 179.575 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.501 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 37.0 tt0 -62.04 -35.08 77.53 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.034 0.445 . . . . 0.0 110.787 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.791 HG22 ' O ' ' B' ' 48' ' ' LEU . 57.9 t -70.44 -40.11 77.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.607 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.502 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 32.9 tt0 -63.39 -32.05 73.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.8 0.809 . . . . 0.0 109.006 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -64.53 -61.19 2.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.588 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.427 HD13 ' HB2' ' C' ' 96' ' ' GLN . 2.6 mm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.353 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' B' ' 53' ' ' GLU . 14.1 pt20 -73.94 -28.78 61.68 Favored 'General case' 0 C--O 1.222 -0.395 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.556 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -67.25 -33.25 82.14 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 119.909 -1.138 . . . . 0.0 110.506 178.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.711 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.8 mm-40 -71.42 -49.66 39.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.547 -0.326 . . . . 0.0 111.263 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.56 -33.06 59.85 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.959 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -66.06 -44.36 84.78 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.899 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -76.01 -19.93 58.25 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.408 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 23.0 mt -71.28 -42.31 68.9 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 5.8 tm0? -69.98 -34.67 73.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.3 -61.94 2.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.459 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.16 -42.78 99.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.666 179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.668 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -56.67 -26.15 55.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.195 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.9 t -54.1 -27.9 35.89 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.272 0.558 . . . . 0.0 110.325 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.582 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 14.3 mt-30 -90.87 -51.0 5.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.592 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.645 ' HA ' HG22 ' B' ' 72' ' ' VAL . 17.4 m-85 -65.72 -17.83 64.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -71.41 -20.64 62.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.979 0.419 . . . . 0.0 110.756 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.17 36.07 2.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.135 0.969 . . . . 0.0 109.181 178.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.645 HG22 ' HA ' ' B' ' 69' ' ' TYR . 15.6 t -99.56 -35.01 4.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.72 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.584 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 46.5 tt0 -88.85 89.12 7.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 122.869 1.319 . . . . 0.0 111.029 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.455 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.2 OUTLIER -167.72 -36.06 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 111.713 -2.494 . . . . 0.0 109.256 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.673 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 57.5 m-85 -56.9 -55.48 43.22 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.327 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.673 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 87.5 Cg_endo -82.15 -177.82 3.72 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 122.273 1.982 . . . . 0.0 111.194 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -92.89 -56.26 3.06 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.114 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 84.35 -107.62 3.02 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.613 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.74 -64.69 4.26 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.705 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.1 pp . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.5 -179.858 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.12 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.476 ' HB3' ' HD3' ' C' ' 83' ' ' PRO . 6.8 tp -63.61 -52.18 60.94 Favored Pre-proline 0 N--CA 1.445 -0.691 0 CA-C-N 117.431 0.615 . . . . 0.0 112.399 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.476 ' HD3' ' HB3' ' C' ' 82' ' ' LEU . 73.1 Cg_exo -43.06 -44.2 9.57 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.675 2.25 . . . . 0.0 112.67 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.98 -32.59 73.96 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.063 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.45 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 89.5 t -62.9 -44.48 99.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.118 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -66.81 -38.35 86.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.401 . . . . 0.0 110.166 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.692 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 20.9 m -62.78 -26.31 68.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.883 0.849 . . . . 0.0 109.287 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.428 ' O ' HG12 ' C' ' 92' ' ' VAL . 63.5 tp -73.09 -42.1 63.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.004 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.658 ' HB3' HH11 ' C' ' 89' ' ' ARG . 0.0 OUTLIER -55.82 -43.82 77.31 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.952 0.342 . . . . 0.0 110.637 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -63.48 -41.74 98.57 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.031 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.43 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 37.4 tt0 -63.0 -36.77 84.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.953 179.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.452 ' O ' HG23 ' C' ' 92' ' ' VAL . 0.2 OUTLIER -74.8 -31.29 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.398 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.581 -179.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' C' ' 96' ' ' GLN . 36.7 tt0 -65.34 -33.49 76.09 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -65.51 -58.85 4.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.657 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.487 HD13 ' HB2' ' A' ' 16' ' ' GLN . 3.3 mm? -60.97 -31.08 70.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.07 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' C' ' 93' ' ' GLU . 14.5 pt20 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.578 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -66.63 -34.11 86.51 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.157 -1.02 . . . . 0.0 110.619 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.5 mm-40 -70.62 -49.43 47.65 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.367 -0.416 . . . . 0.0 111.089 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . . . . . . . . . 7.7 p -68.08 -32.74 57.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 C-N-CA 120.342 -0.543 . . . . 0.0 112.194 -178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.86 -43.21 84.2 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.681 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -76.87 -19.69 57.17 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.013 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 23.6 mt -71.55 -41.95 68.45 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -70.69 -34.21 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.39 -62.4 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.472 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.49 96.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.664 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.574 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -56.27 -28.26 58.02 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.705 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.8 t -51.19 -29.93 15.49 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.133 0.492 . . . . 0.0 110.314 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.53 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 13.6 mt-30 -89.82 -51.33 5.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.047 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.672 ' HA ' HG22 ' C' ' 112' ' ' VAL . 19.3 m-85 -66.34 -17.27 64.67 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -177.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.47 -19.37 62.22 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.984 0.421 . . . . 0.0 110.875 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.08 35.7 3.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.812 0.815 . . . . 0.0 109.29 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.672 HG22 ' HA ' ' C' ' 109' ' ' TYR . 16.2 t -98.28 -36.08 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.835 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.582 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 43.1 tt0 -87.32 89.51 8.02 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.958 1.361 . . . . 0.0 111.039 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER -167.39 -37.54 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.071 -2.331 . . . . 0.0 109.202 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.662 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 58.9 m-85 -56.03 -55.89 36.68 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.243 178.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.662 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 90.3 Cg_endo -81.85 -179.47 4.84 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.089 1.859 . . . . 0.0 111.286 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -91.18 -55.8 3.4 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.912 0.387 . . . . 0.0 111.283 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.95 -107.37 2.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.889 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 81.99 -65.59 4.03 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.621 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.61 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.503 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.04 -0.424 . . . . 0.0 112.04 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.549 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 3.3 mm? -56.05 -55.11 45.15 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.549 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 2.3 Cg_endo -50.62 -41.13 54.54 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.258 2.639 . . . . 0.0 112.624 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.24 -34.5 77.81 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.581 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 1' ' ' GLY . 96.7 t -61.14 -55.38 25.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.955 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.81 -33.46 75.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.112 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.4 m -66.95 -28.71 68.51 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.645 0.735 . . . . 0.0 109.792 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 70.0 tp -73.28 -22.34 60.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.09 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.676 ' HA ' HG21 ' A' ' 12' ' ' VAL . 25.8 mmm-85 -69.13 -23.59 63.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.698 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.3 OUTLIER -75.34 -40.2 58.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.432 ' O ' HD22 ' A' ' 15' ' ' LEU . 11.4 mm100 -72.07 -29.29 63.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.841 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.676 HG21 ' HA ' ' A' ' 9' ' ' ARG . 27.6 m -76.05 -38.71 35.6 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.296 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.58 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 95.7 mt-10 -70.06 -28.84 65.77 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.65 -60.85 2.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.015 177.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD11 ' HA ' ' A' ' 15' ' ' LEU . 2.0 mm? -58.3 -39.43 79.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.58 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 17.0 pt20 -67.13 -28.1 67.86 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.738 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.657 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -66.66 -33.42 84.36 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.714 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 82.3 mt-30 -72.05 -40.42 68.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.718 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 15' ' ' LEU . 2.6 t -67.65 -39.9 83.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.963 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.657 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.2 pt20 -62.18 -42.18 99.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.926 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.52 ' CE1' HD22 ' A' ' 22' ' ' LEU . 5.9 p-80 -81.66 -16.79 50.24 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.44 -0.904 . . . . 0.0 111.56 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -74.01 -43.6 57.43 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -68.07 -36.22 79.49 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.64 70.88 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.159 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.424 ' CB ' ' HE2' ' A' ' 29' ' ' TYR . . . -60.33 -43.91 95.99 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.581 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.612 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 1.8 m-85 -52.28 -30.17 26.68 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.489 0.493 . . . . 0.0 111.953 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.5 t -50.69 -31.92 17.81 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.984 0.421 . . . . 0.0 111.142 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.442 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 97.1 mm-40 -89.57 -44.62 9.96 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.715 ' HA ' HG22 ' A' ' 32' ' ' VAL . 41.8 m-85 -65.21 -20.02 66.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.867 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.3 -26.11 60.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.526 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.23 32.39 4.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.012 0.91 . . . . 0.0 109.453 178.013 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.715 HG22 ' HA ' ' A' ' 29' ' ' TYR . 65.7 t -128.13 -24.48 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.55 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.883 ' HG3' ' H ' ' A' ' 34' ' ' LEU . 3.5 pt-20 -65.18 -63.8 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.718 0.77 . . . . 0.0 112.361 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.883 ' H ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -46.4 -49.21 18.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.53 -1.668 . . . . 0.0 115.107 -177.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.569 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 21.4 m-30 -47.09 -68.03 0.34 Allowed Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 19.1 Cg_endo -64.51 176.82 2.51 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.516 2.144 . . . . 0.0 113.937 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -165.21 153.1 11.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.046 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.74 133.02 34.81 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.447 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -170.67 -110.36 0.23 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.082 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.4 tp . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.406 -0.806 . . . . 0.0 110.431 -179.916 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.487 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.986 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.542 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 3.3 mm? -56.53 -54.8 49.53 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.542 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 2.7 Cg_endo -50.93 -40.14 58.48 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.166 2.578 . . . . 0.0 112.661 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.37 -36.67 84.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.333 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.487 HG23 ' O ' ' B' ' 41' ' ' GLY . 96.4 t -59.07 -55.05 26.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.092 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.482 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.1 -33.71 76.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.327 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.65 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.9 m -67.17 -28.07 67.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.688 0.756 . . . . 0.0 109.594 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 tp -73.15 -23.03 60.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.101 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.675 ' HA ' HG21 ' B' ' 52' ' ' VAL . 24.1 mmm-85 -69.07 -23.16 64.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.65 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.5 OUTLIER -74.99 -40.53 60.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.596 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.483 ' O ' HD22 ' B' ' 55' ' ' LEU . 11.5 mm100 -72.01 -29.12 63.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.872 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.675 HG21 ' HA ' ' B' ' 49' ' ' ARG . 27.2 m -76.4 -38.59 32.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.206 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.585 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 92.6 mt-10 -70.34 -28.06 64.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.79 -60.72 2.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.196 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.783 HD12 HG11 ' C' ' 99' ' ' VAL . 2.1 mm? -58.26 -39.59 79.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.005 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.585 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.7 pt20 -66.92 -28.45 68.31 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.398 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.655 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -66.15 -33.65 85.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.713 178.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.699 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 82.4 mt-30 -71.78 -40.37 69.3 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.497 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.4 HG22 ' O ' ' B' ' 55' ' ' LEU . 2.5 t -67.99 -39.84 82.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.064 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.3 pt20 -61.53 -42.48 98.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.83 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.534 ' CE1' HD22 ' B' ' 62' ' ' LEU . 5.9 p-80 -81.51 -17.77 47.42 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.447 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 6.5 mt -72.73 -43.7 62.64 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.445 ' HG2' HD21 ' A' ' 22' ' ' LEU . 4.9 tm0? -68.36 -36.54 79.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.99 -50.63 70.31 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.589 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.422 ' CB ' ' HE2' ' B' ' 69' ' ' TYR . . . -60.36 -43.83 96.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.394 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.567 ' HA ' ' HD2' ' B' ' 69' ' ' TYR . 1.5 m-85 -51.48 -30.67 20.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.692 0.62 . . . . 0.0 111.854 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 40.6 t -49.82 -33.47 16.81 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.837 0.351 . . . . 0.0 111.106 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.408 ' O ' ' HE2' ' B' ' 71' ' ' LYS . 97.4 mm-40 -88.68 -44.4 10.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.492 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.689 ' HA ' HG22 ' B' ' 72' ' ' VAL . 46.1 m-85 -64.86 -20.5 66.45 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.771 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -57.47 -27.21 62.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.234 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -105.01 31.97 4.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.083 0.944 . . . . 0.0 109.351 178.34 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.689 HG22 ' HA ' ' B' ' 69' ' ' TYR . 64.6 t -127.83 -24.8 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.257 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.876 ' HG3' ' H ' ' B' ' 74' ' ' LEU . 3.4 pt-20 -64.44 -64.53 0.86 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.663 0.744 . . . . 0.0 112.191 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.876 ' H ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -45.62 -50.53 13.21 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 125.987 1.715 . . . . 0.0 115.271 -177.861 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.587 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 21.1 m-30 -46.39 -68.12 0.33 Allowed Pre-proline 0 N--CA 1.477 0.913 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 19.3 Cg_endo -64.23 177.72 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.598 2.198 . . . . 0.0 113.699 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -167.26 152.85 7.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.988 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.18 133.68 36.5 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.635 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.05 -110.04 0.23 Allowed Glycine 0 CA--C 1.51 -0.253 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.13 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 tp . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.013 179.554 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.492 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.565 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 3.3 mm? -56.24 -55.9 37.13 Favored Pre-proline 0 N--CA 1.468 0.427 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.565 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 5.3 Cg_endo -50.18 -40.67 51.26 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.538 2.825 . . . . 0.0 112.673 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -63.4 -34.72 78.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.446 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.492 HG23 ' O ' ' C' ' 81' ' ' GLY . 85.2 t -61.28 -54.86 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.982 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.539 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.76 -33.05 75.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.73 0.3 . . . . 0.0 111.129 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.7 m -66.86 -29.05 68.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.652 0.739 . . . . 0.0 109.489 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.426 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 70.2 tp -72.7 -22.77 60.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.86 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.539 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 31.2 mmm-85 -66.32 -27.46 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.3 OUTLIER -73.02 -42.16 63.48 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.905 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.498 ' O ' HD22 ' C' ' 95' ' ' LEU . 11.6 mm100 -70.83 -27.37 63.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.662 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.426 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 0.8 OUTLIER -76.16 -42.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.314 -178.374 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.599 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 94.2 mt-10 -70.97 -27.16 63.53 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -63.76 -61.08 2.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.257 -1.338 . . . . 0.0 110.079 177.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.498 HD22 ' O ' ' C' ' 91' ' ' GLN . 1.6 mm? -58.09 -37.97 75.52 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.95 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.599 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 16.5 pt20 -69.13 -27.74 65.84 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.611 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.66 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -66.63 -33.44 84.47 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 178.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.448 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 83.5 mt-30 -72.52 -41.93 65.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.403 -0.399 . . . . 0.0 111.181 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.783 HG11 HD12 ' B' ' 55' ' ' LEU . 0.2 OUTLIER -72.38 -30.14 33.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.828 -179.399 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.66 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.0 pt20 -66.6 -43.33 85.15 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.106 -0.237 . . . . 0.0 110.503 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.448 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 8.3 p-80 -79.9 -16.67 54.88 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 119.939 -0.705 . . . . 0.0 111.433 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.612 ' HG ' ' CE2' ' A' ' 26' ' ' PHE . 1.3 mp -75.2 -42.39 55.72 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.09 -50.67 70.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.673 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.405 ' CB ' ' HE2' ' C' ' 109' ' ' TYR . . . -60.21 -43.88 95.59 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.357 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.554 ' HA ' ' HD2' ' C' ' 109' ' ' TYR . 1.6 m-85 -52.14 -30.42 26.46 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.942 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.9 t -49.94 -33.78 18.6 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.979 0.419 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.411 ' O ' ' HE2' ' C' ' 111' ' ' LYS . 97.1 mm-40 -87.46 -45.85 10.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.722 ' HA ' HG22 ' C' ' 112' ' ' VAL . 43.5 m-85 -64.28 -20.53 66.13 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.933 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -56.2 -28.0 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -105.23 32.07 4.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.947 0.879 . . . . 0.0 109.758 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.722 HG22 ' HA ' ' C' ' 109' ' ' TYR . 59.8 t -128.04 -23.96 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.2 -1.363 . . . . 0.0 110.479 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.823 ' HG3' ' H ' ' C' ' 114' ' ' LEU . 3.6 pt-20 -66.49 -60.44 2.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.875 0.845 . . . . 0.0 112.879 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.823 ' H ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -50.69 -46.35 58.7 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 113.859 -1.519 . . . . 0.0 115.04 -177.282 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.537 ' HB2' ' CD ' ' C' ' 116' ' ' PRO . 21.3 m-30 -48.7 -67.58 0.41 Allowed Pre-proline 0 N--CA 1.473 0.707 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 -177.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.537 ' CD ' ' HB2' ' C' ' 115' ' ' PHE . 25.9 Cg_endo -65.61 176.89 3.12 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.522 2.148 . . . . 0.0 113.92 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -165.6 153.81 11.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.105 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -66.91 134.18 31.94 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.568 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -171.36 -111.12 0.25 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 C--O 1.248 0.977 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.873 179.104 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.437 ' O ' HG22 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.911 0 CA-C-O 120.024 -0.32 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.535 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 6.7 mp -58.41 -56.84 31.28 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 119.255 -0.402 . . . . 0.0 111.381 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 81.6 Cg_exo -43.44 -45.49 10.28 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.879 2.386 . . . . 0.0 112.947 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.89 -41.76 92.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.207 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.437 HG22 ' O ' ' A' ' 1' ' ' GLY . 97.8 t -60.97 -51.31 74.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.799 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.511 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.44 -33.25 74.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.084 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.736 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 7.9 t -68.14 -20.8 64.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.585 ' O ' HG22 ' A' ' 12' ' ' VAL . 59.2 tp -76.2 -28.14 57.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.152 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 23.6 mmm-85 -62.91 -43.67 98.16 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.736 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.49 -37.09 82.33 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.566 178.806 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.531 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 84.7 mt-30 -63.33 -33.77 76.26 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 121.529 0.68 . . . . 0.0 109.469 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.585 HG22 ' O ' ' A' ' 8' ' ' LEU . 54.1 t -72.11 -35.08 52.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.469 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 97.7 mt-10 -66.35 -26.2 67.17 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.387 0.613 . . . . 0.0 109.545 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -69.43 -53.15 20.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.221 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -56.52 -35.31 67.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.489 ' O ' HG12 ' A' ' 19' ' ' VAL . 21.6 tt0 -71.3 -43.43 67.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.152 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.415 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -60.59 -31.83 76.22 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.871 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.574 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 58.9 mt-30 -75.27 -41.92 56.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.829 0.347 . . . . 0.0 111.167 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 16' ' ' GLN . 7.4 p -73.95 -27.4 22.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.59 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.415 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 17.8 pt20 -74.11 -40.01 62.97 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.571 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.574 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.3 p-80 -80.95 -19.9 43.17 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.602 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.695 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.8 mp -79.85 -33.99 39.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.642 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.696 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.4 tm0? -74.46 -30.2 61.77 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.3 -62.68 1.7 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.775 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -58.41 -43.29 88.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.371 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.592 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -53.86 -32.06 51.75 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.074 -179.636 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.5 t -50.51 -33.92 23.3 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.711 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.7 mt-30 -82.7 -46.78 12.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.236 0.541 . . . . 0.0 110.981 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.595 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 24.9 m-85 -71.29 -18.86 62.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.098 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 30' ' ' LYS . 14.2 tmtt? -72.91 -25.71 61.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.752 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.73 29.49 6.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.724 0.773 . . . . 0.0 109.347 177.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.595 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 8.8 t -95.27 -36.79 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.01 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.515 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 14.1 tt0 -95.2 101.05 12.77 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.744 1.259 . . . . 0.0 111.11 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.515 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -164.04 -39.9 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 112.738 -2.028 . . . . 0.0 109.365 -179.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.904 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 36.7 m-85 -66.63 -62.1 4.34 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.068 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.904 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 33.1 Cg_endo -91.64 -177.22 0.94 Allowed 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.955 2.436 . . . . 0.0 113.002 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.519 ' ND2' ' HB ' ' A' ' 40' ' ' ILE . 47.7 t30 -129.33 106.63 8.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.402 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.83 140.86 18.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.432 -0.89 . . . . 0.0 112.648 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 103.73 -48.15 1.04 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.71 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.519 ' HB ' ' ND2' ' A' ' 37' ' ' ASN . 26.9 mt . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.514 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.468 ' O ' HG22 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.834 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.56 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 6.9 mp -59.07 -58.13 21.83 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 119.439 -0.315 . . . . 0.0 111.054 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.56 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 73.0 Cg_exo -41.55 -46.53 6.08 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 123.517 2.811 . . . . 0.0 113.273 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.26 -42.85 96.2 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.864 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.468 HG22 ' O ' ' B' ' 41' ' ' GLY . 95.5 t -59.66 -51.0 77.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.729 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.507 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.56 -33.1 74.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.748 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 8.2 t -68.81 -20.29 64.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.528 0.68 . . . . 0.0 109.277 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.606 ' O ' HG22 ' B' ' 52' ' ' VAL . 59.4 tp -76.0 -28.51 57.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.139 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 23.6 mmm-85 -62.88 -43.76 97.92 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.748 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -67.73 -36.59 80.86 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.649 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.534 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 86.1 mt-30 -63.46 -33.54 75.78 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.547 0.689 . . . . 0.0 109.325 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.606 HG22 ' O ' ' B' ' 48' ' ' LEU . 63.1 t -73.05 -34.68 46.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.128 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 96.7 mt-10 -66.17 -25.71 67.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.494 0.664 . . . . 0.0 109.241 178.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -70.06 -52.91 20.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.679 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.24 -34.82 68.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.265 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.46 ' O ' HG12 ' B' ' 59' ' ' VAL . 21.5 tt0 -71.48 -43.14 67.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.216 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -60.6 -32.37 78.1 Favored Glycine 0 C--N 1.319 -0.415 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.592 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.579 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 58.9 mt-30 -74.89 -41.63 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.824 0.345 . . . . 0.0 111.418 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.46 HG12 ' O ' ' B' ' 56' ' ' GLN . 8.1 p -74.14 -26.73 21.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.586 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.427 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 17.2 pt20 -74.46 -40.8 61.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.563 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.5 p-80 -80.16 -19.89 46.12 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.665 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.684 HD11 ' HG2' ' C' ' 103' ' ' GLN . 1.8 mp -79.51 -34.16 41.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.23 -0.588 . . . . 0.0 109.644 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD11 ' A' ' 22' ' ' LEU . 4.8 tm0? -74.34 -30.63 62.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.9 -63.17 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.025 -1.443 . . . . 0.0 109.751 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.486 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -57.24 -43.7 83.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.225 178.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.609 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -53.64 -32.64 52.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.012 -179.613 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.7 t -50.41 -32.58 18.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.855 0.36 . . . . 0.0 110.999 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.734 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 8.2 mt-30 -84.31 -46.65 11.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.171 0.51 . . . . 0.0 110.883 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.586 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 22.8 m-85 -70.88 -19.11 62.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.031 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.451 ' O ' ' HD3' ' B' ' 70' ' ' LYS . 14.0 tmtt? -73.04 -24.78 60.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.981 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.734 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -107.53 29.65 7.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.952 0.882 . . . . 0.0 109.45 176.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.586 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 8.1 t -95.24 -37.56 7.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.107 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.504 ' C ' ' HG ' ' B' ' 74' ' ' LEU . 14.2 tt0 -95.11 99.94 11.84 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 111.06 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.504 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.1 OUTLIER -162.2 -41.27 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.826 179.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.92 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 34.8 m-85 -64.83 -62.5 4.79 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.425 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.92 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 41.5 Cg_endo -91.12 -174.39 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.912 2.408 . . . . 0.0 112.641 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . 0.475 ' ND2' ' HB ' ' B' ' 80' ' ' ILE . 47.3 t30 -132.6 105.43 7.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.378 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.06 141.18 19.09 Favored Glycine 0 CA--C 1.511 -0.191 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.805 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 104.28 -48.24 1.01 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.653 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.475 ' HB ' ' ND2' ' B' ' 77' ' ' ASN . 25.5 mt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.598 -0.715 . . . . 0.0 109.969 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.439 ' O ' HG22 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.936 0 N-CA-C 112.29 -0.324 . . . . 0.0 112.29 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.566 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 6.8 mp -59.24 -56.7 33.41 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.281 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 75.2 Cg_exo -43.76 -44.86 11.39 Favored 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 123.096 2.531 . . . . 0.0 113.187 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.91 -42.6 98.36 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.738 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.439 HG22 ' O ' ' C' ' 81' ' ' GLY . 86.2 t -60.03 -51.35 73.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.779 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.526 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.53 -32.31 73.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.772 0.32 . . . . 0.0 111.497 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.733 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 7.9 t -69.27 -20.61 63.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.639 0.733 . . . . 0.0 109.209 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.603 ' O ' HG22 ' C' ' 92' ' ' VAL . 59.6 tp -75.78 -27.75 58.12 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.218 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 23.4 mmm-85 -63.37 -43.6 97.19 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.733 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.5 -35.59 77.72 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.46 179.067 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.537 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 85.4 mt-30 -64.07 -33.41 75.69 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 109.376 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.603 HG22 ' O ' ' C' ' 88' ' ' LEU . 54.8 t -72.54 -35.65 51.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.256 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 96.6 mt-10 -65.24 -27.54 68.73 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -68.34 -53.08 26.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.854 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -57.4 -34.84 69.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.294 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.473 ' O ' HG12 ' C' ' 99' ' ' VAL . 17.4 tt0 -71.12 -42.81 68.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.169 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.484 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.03 -31.67 77.46 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.86 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.606 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 57.9 mt-30 -75.41 -41.67 55.5 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.558 -0.378 . . . . 0.0 111.132 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.473 HG12 ' O ' ' C' ' 96' ' ' GLN . 7.6 p -73.96 -27.15 21.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.488 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.484 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 15.6 pt20 -74.12 -41.68 61.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 121.11 -0.236 . . . . 0.0 110.505 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.606 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.6 p-80 -79.29 -19.98 49.13 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.596 -0.842 . . . . 0.0 110.841 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.696 HD11 ' HG2' ' A' ' 23' ' ' GLN . 1.8 mp -79.37 -34.68 41.77 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.684 ' HG2' HD11 ' B' ' 62' ' ' LEU . 4.3 tm0? -73.81 -31.3 63.17 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 177.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.48 -63.06 1.41 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.678 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.474 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -57.82 -43.68 85.92 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.185 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -53.48 -32.34 49.72 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.384 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 45.9 t -50.91 -33.95 26.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.164 0.507 . . . . 0.0 110.815 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.71 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 8.3 mt-30 -81.99 -46.95 13.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.178 0.514 . . . . 0.0 110.908 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.595 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 26.4 m-85 -70.68 -18.93 62.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.138 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.435 ' HD3' ' O ' ' C' ' 110' ' ' LYS . 14.3 tmtt? -73.38 -24.92 60.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.905 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.71 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -107.21 28.12 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.791 0.805 . . . . 0.0 109.39 176.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.595 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 7.8 t -94.08 -36.9 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.08 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.481 ' HB2' HG22 ' B' ' 72' ' ' VAL . 9.0 tt0 -96.39 102.42 14.21 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.651 1.215 . . . . 0.0 110.808 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.679 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -167.32 -32.83 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.548 -2.115 . . . . 0.0 110.022 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.909 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 43.4 m-85 -71.32 -61.04 2.36 Favored Pre-proline 0 CA--C 1.536 0.411 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 177.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.909 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 41.7 Cg_endo -91.3 -174.01 0.6 Allowed 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.919 2.413 . . . . 0.0 112.57 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . 0.49 ' ND2' ' HB ' ' C' ' 120' ' ' ILE . 45.9 t30 -133.16 105.0 6.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.648 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -84.26 141.46 19.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.868 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 103.28 -46.44 1.21 Allowed Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.721 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.49 ' HB ' ' ND2' ' C' ' 117' ' ' ASN . 27.0 mt . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.068 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.987 0 N-CA-C 112.039 -0.424 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.461 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 1.1 mm? -57.36 -54.99 49.06 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 117.068 0.434 . . . . 0.0 111.019 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.461 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 70.9 Cg_exo -40.92 -46.96 4.95 Favored 'Trans proline' 0 C--N 1.362 1.256 0 C-N-CA 123.615 2.876 . . . . 0.0 113.754 -178.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -63.49 -49.0 75.32 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.474 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 58.5 t -61.96 -53.29 49.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.692 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.74 -30.4 71.5 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.641 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 44.4 t -63.96 -30.2 71.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.673 0.749 . . . . 0.0 109.293 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.63 HD21 HD21 ' C' ' 88' ' ' LEU . 59.2 tp -73.32 -25.73 60.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.692 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -69.03 -21.57 64.11 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.7 mt-30 -75.62 -40.53 56.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -69.23 -26.24 64.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.283 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.666 HG22 ' O ' ' A' ' 9' ' ' ARG . 15.2 m -78.21 -33.84 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.236 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.539 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 62.7 mm-40 -65.52 -34.4 78.16 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.89 6.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.952 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.416 HD11 HG11 ' B' ' 59' ' ' VAL . 41.8 tp -59.06 -39.34 81.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.742 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.539 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 18.0 pt20 -70.08 -23.28 63.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.649 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.561 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -68.72 -31.17 72.93 Favored Glycine 0 C--O 1.239 0.428 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.935 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.68 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.1 mm100 -73.27 -49.08 29.62 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.441 0.638 . . . . 0.0 110.629 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.573 ' HB ' HG21 ' B' ' 59' ' ' VAL . 7.7 p -70.02 -26.34 29.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 C-N-CA 120.226 -0.59 . . . . 0.0 112.027 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -71.66 -42.46 67.49 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.142 -0.349 . . . . 0.0 110.376 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.474 ' O ' ' HB1' ' A' ' 24' ' ' ALA . 6.0 p-80 -76.2 -18.13 59.21 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.613 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 18.6 mt -74.08 -39.86 63.14 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.571 ' HG2' HD23 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -69.4 -34.23 74.19 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.086 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -54.78 -63.62 1.09 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.289 177.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.18 -40.47 85.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.681 179.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.544 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -55.16 -30.82 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.112 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -58.17 -31.52 67.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -88.56 -15.56 34.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.154 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.765 ' HA ' HG23 ' A' ' 32' ' ' VAL . 41.0 m-85 -99.96 -15.29 18.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.606 0.717 . . . . 0.0 110.543 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.44 ' HG2' ' OH ' ' C' ' 109' ' ' TYR . 1.4 tmtp? -64.46 -33.22 75.38 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.793 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -101.38 23.77 10.56 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.253 0.549 . . . . 0.0 110.507 179.398 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.765 HG23 ' HA ' ' A' ' 29' ' ' TYR . 26.5 t -92.75 -26.27 4.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.54 ' O ' ' HD2' ' A' ' 36' ' ' PRO . 10.3 tm-20 -64.35 -69.61 0.27 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -43.64 -38.13 2.91 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -177.394 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.622 ' N ' HD22 ' A' ' 34' ' ' LEU . 16.4 m-30 -41.32 -72.35 0.12 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.597 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 88.5 Cg_endo -79.37 177.45 8.54 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.192 1.928 . . . . 0.0 112.309 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -110.84 91.94 3.86 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.528 ' HA3' ' CE2' ' C' ' 115' ' ' PHE . . . -71.75 159.74 53.87 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.771 -0.728 . . . . 0.0 113.077 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 131.88 -70.01 0.52 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.942 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.478 HD13 HG21 ' A' ' 40' ' ' ILE . 41.7 mm . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.904 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.125 0 N-CA-C 112.027 -0.429 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.456 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 1.0 OUTLIER -57.75 -55.06 48.79 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 117.135 0.467 . . . . 0.0 111.132 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.456 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 76.6 Cg_exo -40.58 -47.49 4.5 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 123.43 2.753 . . . . 0.0 113.823 -178.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -63.1 -50.05 72.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.79 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.47 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 59.8 t -60.88 -52.24 63.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.155 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.724 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.45 -30.29 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.036 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.636 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 47.1 t -63.59 -30.55 71.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.638 0.733 . . . . 0.0 109.101 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.663 HD21 HD21 ' C' ' 88' ' ' LEU . 57.7 tp -73.84 -25.69 60.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.57 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.724 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -69.37 -20.29 63.83 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.636 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.8 mt-30 -77.03 -40.1 47.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -69.73 -26.61 64.41 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.985 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.664 HG22 ' O ' ' B' ' 49' ' ' ARG . 17.5 m -77.54 -34.32 20.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.302 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.551 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 62.9 mm-40 -65.12 -34.33 78.13 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.75 -59.34 5.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.865 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 45.4 tp -58.98 -39.11 80.76 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.961 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.551 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 17.4 pt20 -70.2 -23.36 62.93 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.623 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.564 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -69.36 -29.42 71.81 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.881 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.702 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.1 mm100 -74.35 -48.21 29.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.365 0.603 . . . . 0.0 110.784 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.573 HG21 ' HB ' ' A' ' 19' ' ' VAL . 6.9 p -70.75 -26.55 28.34 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.713 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.564 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -71.6 -41.99 68.27 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.361 178.409 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.497 ' O ' ' HB1' ' B' ' 64' ' ' ALA . 6.2 p-80 -76.33 -19.57 58.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.595 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 17.8 mt -72.1 -40.8 67.94 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.532 ' HG2' HD23 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -69.23 -34.07 74.27 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.414 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -54.7 -63.14 1.25 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.254 178.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.87 85.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.579 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.521 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.86 -30.04 60.87 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.17 -179.33 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.6 t -59.6 -29.78 68.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.286 0.565 . . . . 0.0 110.79 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -89.07 -15.81 33.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.365 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.798 ' HA ' HG23 ' B' ' 72' ' ' VAL . 39.2 m-85 -100.66 -15.81 17.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.647 0.737 . . . . 0.0 110.454 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.5 -32.51 74.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.7 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -101.61 23.8 10.68 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.731 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.798 HG23 ' HA ' ' B' ' 69' ' ' TYR . 33.4 t -93.07 -26.54 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.507 ' O ' ' HD2' ' B' ' 76' ' ' PRO . 9.2 tm-20 -64.3 -68.43 0.35 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.623 HD22 ' N ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -44.99 -37.77 4.26 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -177.14 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.623 ' N ' HD22 ' B' ' 74' ' ' LEU . 15.3 m-30 -41.16 -72.52 0.11 Allowed Pre-proline 0 N--CA 1.48 1.025 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.581 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 83.5 Cg_endo -79.35 179.12 6.68 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.296 1.997 . . . . 0.0 112.21 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -112.19 91.43 3.65 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . 0.507 ' HA3' ' CE2' ' A' ' 35' ' ' PHE . . . -71.36 157.78 53.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.879 -0.676 . . . . 0.0 113.244 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 -68.83 0.54 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.417 HG21 HD13 ' B' ' 80' ' ' ILE . 40.9 mm . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.685 -0.674 . . . . 0.0 109.863 179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.412 ' O ' HG22 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.44 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 9.2 mt -62.44 -53.84 54.11 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-O 119.081 -0.485 . . . . 0.0 111.801 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.44 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 77.6 Cg_exo -41.01 -46.53 5.07 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 123.449 2.766 . . . . 0.0 113.085 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -62.71 -51.07 68.62 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.891 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.467 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 62.2 t -60.38 -52.69 58.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.987 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.732 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.65 -28.43 69.61 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.643 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 40.9 t -66.38 -29.66 69.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.596 0.712 . . . . 0.0 109.289 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.663 HD21 HD21 ' B' ' 48' ' ' LEU . 62.2 tp -73.66 -24.09 59.94 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.909 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.732 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -68.61 -23.32 64.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.643 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.2 mt-30 -75.87 -41.29 52.66 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.4 ' O ' ' HB1' ' C' ' 94' ' ' ALA . 75.2 mt-30 -69.09 -23.55 64.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.019 178.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.59 -40.81 28.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.277 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 55.4 mm-40 -64.55 -33.09 75.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.055 0.931 . . . . 0.0 108.56 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.4 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -61.72 -58.84 6.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.139 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.413 HD11 HG11 ' A' ' 19' ' ' VAL . 42.0 tp -59.52 -40.61 87.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.773 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' C' ' 99' ' ' VAL . 17.9 pt20 -68.02 -24.15 65.08 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.575 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.572 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -67.39 -30.95 75.81 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.096 -1.05 . . . . 0.0 110.949 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.673 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 9.6 mm100 -72.54 -46.51 54.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.801 0.334 . . . . 0.0 110.269 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -66.75 -34.69 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.53 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.85 -41.48 87.29 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.675 -177.589 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.501 ' O ' ' HB1' ' C' ' 104' ' ' ALA . 5.4 p-80 -77.64 -19.81 54.86 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.101 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.673 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 18.1 mt -73.45 -40.3 64.3 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.511 ' HG2' HD23 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -69.82 -34.17 73.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.328 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -54.76 -63.18 1.23 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.059 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.14 -40.15 84.62 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.853 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.63 -31.43 62.3 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.091 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 33.7 t -57.58 -29.21 64.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.158 0.504 . . . . 0.0 110.632 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -90.81 -15.65 29.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.592 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.793 ' HA ' HG23 ' C' ' 112' ' ' VAL . 41.1 m-85 -100.78 -16.07 17.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.499 0.666 . . . . 0.0 110.642 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.404 ' HG2' ' OH ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -67.47 -26.73 66.52 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.972 -179.143 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER -104.38 22.43 14.89 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.176 177.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.793 HG23 ' HA ' ' C' ' 109' ' ' TYR . 37.2 t -92.13 -26.3 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.495 ' O ' ' HD2' ' C' ' 116' ' ' PRO . 9.3 tm-20 -64.28 -68.05 0.38 Allowed 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.636 HD22 ' N ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -44.82 -39.07 4.99 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 -177.331 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.636 ' N ' HD22 ' C' ' 114' ' ' LEU . 15.9 m-30 -40.41 -72.13 0.12 Allowed Pre-proline 0 N--CA 1.481 1.079 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 88.7 Cg_endo -79.11 179.55 6.36 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.201 1.934 . . . . 0.0 112.371 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -113.03 89.79 3.18 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . 0.531 ' HA3' ' CE2' ' B' ' 75' ' ' PHE . . . -70.24 157.29 53.52 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.33 -178.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 133.79 -69.57 0.53 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.449 HD13 HG21 ' C' ' 120' ' ' ILE . 37.1 mm . . . . . 0 C--O 1.245 0.868 0 CA-C-O 118.582 -0.723 . . . . 0.0 109.89 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.453 ' HA2' HD22 ' B' ' 42' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.544 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 32.6 mt -57.45 -55.38 45.11 Favored Pre-proline 0 N--CA 1.467 0.422 0 CA-C-O 119.254 -0.403 . . . . 0.0 111.566 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.544 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 32.4 Cg_exo -45.58 -46.91 14.13 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.905 2.403 . . . . 0.0 112.323 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.811 ' HB3' HH22 ' B' ' 49' ' ' ARG . 3.1 m-20 -58.37 -34.63 70.89 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.425 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.561 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 91.1 t -61.14 -47.93 91.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.217 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.669 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.09 -32.43 73.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.841 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.694 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 34.5 m -71.4 -23.11 61.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.857 0.837 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.422 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 62.0 tp -77.89 -22.53 49.62 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.763 HH22 ' HB3' ' C' ' 84' ' ' ASP . 0.0 OUTLIER -64.14 -44.13 93.13 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.056 178.227 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.694 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -70.39 -47.22 61.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.269 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 13.0 mm100 -61.64 -39.12 90.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.241 0.543 . . . . 0.0 110.838 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.422 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 2.6 t -73.2 -27.38 24.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.958 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.692 ' HA ' HE21 ' A' ' 16' ' ' GLN . 19.1 tt0 -67.31 -33.64 75.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.66 -60.83 2.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.632 178.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.546 HD13 ' HB2' ' B' ' 56' ' ' GLN . 3.4 mm? -57.32 -37.21 72.13 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.371 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.692 HE21 ' HA ' ' A' ' 13' ' ' GLU . 21.8 pt20 -72.16 -30.41 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.403 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -65.43 -30.32 77.31 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 177.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.738 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 76.4 mt-30 -70.56 -48.36 55.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.896 -0.652 . . . . 0.0 110.669 178.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.406 HG22 ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.93 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 10.5 pt20 -59.79 -43.35 94.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.316 -178.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 5.1 p-80 -79.11 -14.55 59.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.544 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.738 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -75.66 -42.43 51.33 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.42 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.1 tm0? -68.77 -38.97 80.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.437 ' HB3' ' HA ' ' A' ' 21' ' ' HIS . . . -54.5 -48.05 72.32 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.484 177.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.31 -47.15 85.53 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.118 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -50.3 -25.77 4.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.426 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 47.7 t -49.64 -30.0 8.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.626 ' HG3' ' OE1' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -107.84 -11.62 15.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.528 ' CE2' ' HA ' ' B' ' 70' ' ' LYS . 55.0 m-85 -94.94 -21.87 18.35 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.771 -0.581 . . . . 0.0 109.696 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.548 ' HA ' ' CE2' ' C' ' 109' ' ' TYR . 22.7 pttp -59.64 -21.15 60.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.746 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -103.97 33.55 3.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.444 178.316 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 32' ' ' VAL . 71.1 t -124.91 -24.87 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.963 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.822 ' HG3' HD13 ' A' ' 34' ' ' LEU . 16.9 pt-20 -61.76 -40.77 96.29 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.822 HD13 ' HG3' ' A' ' 33' ' ' GLU . 0.5 OUTLIER -54.82 -74.45 0.04 OUTLIER 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -176.351 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.474 ' N ' ' CD1' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -104.31 53.03 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -174.142 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD2' ' O ' ' A' ' 34' ' ' LEU . 48.0 Cg_endo -64.41 175.28 3.51 Favored 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 121.914 1.743 . . . . 0.0 110.623 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -111.51 80.28 1.3 Allowed 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.911 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -100.66 46.67 1.31 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.442 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -103.6 -88.17 2.04 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.742 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.419 HD11 HG22 ' A' ' 40' ' ' ILE . 42.1 mm . . . . . 0 C--O 1.244 0.77 0 CA-C-O 118.565 -0.731 . . . . 0.0 110.552 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.872 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.546 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 32.6 mt -58.67 -55.93 40.97 Favored Pre-proline 0 N--CA 1.469 0.49 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.543 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.546 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 31.7 Cg_exo -45.23 -45.83 14.48 Favored 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.996 2.464 . . . . 0.0 112.597 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.788 ' HB3' HH22 ' C' ' 89' ' ' ARG . 2.3 m-20 -59.51 -32.87 70.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.517 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.581 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 99.1 t -63.04 -47.44 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.95 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.673 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.7 -31.84 72.08 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.819 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.711 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 40.5 m -71.47 -23.78 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.678 0.751 . . . . 0.0 109.297 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.416 HD13 HG22 ' B' ' 52' ' ' VAL . 64.4 tp -77.57 -22.29 51.19 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.811 HH22 ' HB3' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -63.94 -44.66 92.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.071 178.045 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.711 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.0 OUTLIER -69.93 -47.69 61.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 13.2 mm100 -61.3 -38.55 87.2 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.455 0.645 . . . . 0.0 110.912 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.416 HG22 HD13 ' B' ' 48' ' ' LEU . 2.6 t -74.03 -27.28 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.105 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.716 ' HA ' HE21 ' B' ' 56' ' ' GLN . 22.0 tt0 -67.3 -33.01 74.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -66.16 -59.83 3.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.835 178.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.517 HD13 ' HB2' ' C' ' 96' ' ' GLN . 3.4 mm? -58.55 -37.25 75.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.706 -1.134 . . . . 0.0 112.105 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.716 HE21 ' HA ' ' B' ' 53' ' ' GLU . 21.9 pt20 -71.83 -30.09 65.11 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.632 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.4 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -65.44 -31.82 81.51 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.776 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 76.4 mt-30 -69.85 -47.23 63.49 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.928 -0.636 . . . . 0.0 110.727 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.12 -44.62 99.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.693 -179.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 11.0 pt20 -59.26 -42.44 91.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.6 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.439 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -80.31 -15.07 57.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.288 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.776 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.3 mt -74.82 -42.16 58.57 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.447 ' HG2' HD21 ' A' ' 22' ' ' LEU . 1.9 tm0? -69.12 -38.82 79.1 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.419 ' HB3' ' HA ' ' B' ' 61' ' ' HIS . . . -54.71 -48.94 71.85 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.202 177.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -60.95 -47.49 86.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.099 178.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -50.38 -26.15 4.65 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' SER . . . . . 0.453 ' O ' ' HE3' ' B' ' 70' ' ' LYS . 46.7 t -49.55 -30.11 8.0 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.626 ' HG3' ' OE1' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -108.25 -9.34 15.53 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.542 ' CE2' ' HA ' ' C' ' 110' ' ' LYS . 60.6 m-85 -97.27 -21.41 17.27 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.528 ' HA ' ' CE2' ' A' ' 29' ' ' TYR . 22.6 pttp -59.16 -22.05 60.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.668 -178.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -103.5 33.77 3.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.537 0.684 . . . . 0.0 110.584 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.432 HG12 ' O ' ' B' ' 72' ' ' VAL . 72.1 t -125.29 -24.27 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.835 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.843 ' HG3' HD13 ' B' ' 74' ' ' LEU . 17.1 pt-20 -61.8 -40.39 95.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.843 HD13 ' HG3' ' B' ' 73' ' ' GLU . 0.5 OUTLIER -55.71 -74.22 0.05 OUTLIER 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.089 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.5 ' CD1' ' N ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -104.28 52.21 0.09 OUTLIER Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 117.478 2.399 . . . . 0.0 117.478 -174.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.439 ' HD2' ' O ' ' B' ' 74' ' ' LEU . 44.5 Cg_endo -63.9 176.01 2.69 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.901 1.734 . . . . 0.0 110.527 176.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -112.12 80.36 1.32 Allowed 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.789 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.32 47.38 1.27 Allowed Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.493 -0.861 . . . . 0.0 112.26 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -105.19 -88.02 2.03 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.314 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.4 mm . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.325 179.73 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.473 ' HA2' HD22 ' A' ' 2' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.13 -56.02 38.02 Favored Pre-proline 0 N--CA 1.469 0.505 0 CA-C-O 119.357 -0.354 . . . . 0.0 111.671 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -45.75 -46.6 15.01 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.742 2.295 . . . . 0.0 112.626 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . 0.763 ' HB3' HH22 ' A' ' 9' ' ' ARG . 2.6 m-20 -59.28 -31.87 69.51 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.674 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.589 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 93.2 t -63.86 -47.48 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.041 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.692 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.14 -31.93 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.734 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 22.5 m -71.75 -23.87 61.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.811 0.815 . . . . 0.0 109.545 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.448 HD13 HG22 ' C' ' 92' ' ' VAL . 62.9 tp -77.42 -22.32 51.72 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.788 HH22 ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -64.39 -43.24 95.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.252 178.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.697 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.1 pt20 -71.46 -47.35 56.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.196 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 11.8 mm100 -61.31 -39.07 89.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.217 0.532 . . . . 0.0 111.005 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.448 HG22 HD13 ' C' ' 88' ' ' LEU . 2.6 t -73.31 -27.81 24.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.068 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.74 ' HA ' HE21 ' C' ' 96' ' ' GLN . 22.9 tt0 -66.86 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -66.37 -59.98 3.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.902 178.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.535 HD13 ' HB2' ' A' ' 16' ' ' GLN . 3.6 mm? -58.48 -35.86 72.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.275 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.74 HE21 ' HA ' ' C' ' 93' ' ' GLU . 22.0 pt20 -73.58 -30.26 62.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.409 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.436 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.23 -29.52 75.07 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 177.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.758 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 76.3 mt-30 -72.27 -49.55 33.96 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.015 -0.593 . . . . 0.0 111.019 178.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.422 ' CG1' ' HA ' ' C' ' 96' ' ' GLN . 1.6 p -66.5 -34.61 71.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 10.4 pt20 -64.89 -43.97 91.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.554 -0.459 . . . . 0.0 111.104 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.423 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.8 p-80 -77.94 -15.13 59.24 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.83 -0.748 . . . . 0.0 111.037 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.758 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.1 mt -73.9 -41.62 61.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.484 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.2 tm0? -69.95 -37.97 76.0 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.14 74.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.379 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -61.25 -47.89 83.96 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.799 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -49.6 -26.18 3.39 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 107' ' ' SER . . . . . 0.475 ' O ' ' HE3' ' C' ' 110' ' ' LYS . 36.9 t -49.79 -30.52 9.79 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.619 ' HG3' ' OE1' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -106.87 -11.41 15.74 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.548 ' CE2' ' HA ' ' A' ' 30' ' ' LYS . 53.1 m-85 -94.94 -21.93 18.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.645 178.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.542 ' HA ' ' CE2' ' B' ' 69' ' ' TYR . 22.8 pttp -59.28 -21.19 59.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.003 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.09 33.52 3.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 110.325 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.461 ' O ' HG12 ' C' ' 112' ' ' VAL . 70.3 t -125.29 -25.92 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.59 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.626 ' OE1' ' HG3' ' B' ' 68' ' ' GLN . 16.6 pt-20 -59.7 -42.72 93.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.4 OUTLIER -55.81 -69.96 0.13 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -176.028 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.448 ' CD1' ' N ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -108.09 52.09 0.21 Allowed Pre-proline 0 C--N 1.313 -1.01 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -175.447 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.401 ' HD2' ' O ' ' C' ' 114' ' ' LEU . 56.1 Cg_endo -64.01 174.94 3.47 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 122.193 1.928 . . . . 0.0 110.646 176.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -112.15 81.68 1.51 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.738 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -101.3 46.66 1.27 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.339 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.19 -88.86 2.08 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.479 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.409 HG22 HD11 ' C' ' 120' ' ' ILE . 40.5 mm . . . . . 0 C--O 1.244 0.78 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.05 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.871 0 N-CA-C 112.126 -0.389 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.495 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 6.6 mp -57.9 -57.42 25.83 Favored Pre-proline 0 N--CA 1.467 0.4 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 1.1 Cg_endo -51.07 -36.21 53.86 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.993 2.462 . . . . 0.0 112.602 -178.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.98 -34.13 72.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.864 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.401 HG23 HG11 ' B' ' 45' ' ' VAL . 69.5 t -76.55 -47.29 29.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.328 178.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.791 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -70.74 -20.79 62.6 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.74 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.672 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 32.1 t -67.88 -27.63 66.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 65.2 tp -74.34 -22.85 59.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.626 178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.791 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 mmt85 -69.5 -22.1 63.63 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.5 mt-30 -73.75 -39.31 64.32 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.541 ' O ' HD22 ' A' ' 15' ' ' LEU . 9.8 mm100 -69.52 -33.17 72.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.577 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.768 HG22 ' HA ' ' A' ' 9' ' ' ARG . 29.0 m -74.53 -31.61 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.697 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.605 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.2 mt-10 -70.43 -29.73 66.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.48 -53.03 48.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.611 177.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.541 HD22 ' O ' ' A' ' 11' ' ' GLN . 3.9 mm? -57.71 -37.4 73.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.233 -1.349 . . . . 0.0 111.632 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.605 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 19.6 pt20 -76.48 -25.03 53.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.215 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.824 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -69.7 -37.52 76.63 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.801 -1.19 . . . . 0.0 110.701 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.69 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 65.4 mt-30 -72.88 -46.63 51.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.026 -0.587 . . . . 0.0 111.321 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.642 HG22 HD11 ' C' ' 102' ' ' LEU . 14.8 p -69.23 -32.83 55.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.693 -179.028 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.824 HE21 ' HA2' ' A' ' 17' ' ' GLY . 14.8 pt20 -67.55 -41.74 83.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.842 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.402 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.3 p-80 -78.61 -19.44 52.68 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.271 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -71.95 -43.73 64.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.6 tm0? -70.38 -33.34 71.29 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.35 -56.05 26.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.866 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.38 -41.38 98.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.132 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -26.06 59.02 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.519 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -53.43 -26.64 20.78 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.27 0.557 . . . . 0.0 110.34 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.418 HE21 ' HB3' ' A' ' 28' ' ' GLN . 4.1 mm100 -93.02 -53.66 4.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.589 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.577 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 21.7 m-85 -63.13 -20.15 65.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -67.09 -24.27 65.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.781 0.324 . . . . 0.0 110.756 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.526 ' O ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -109.84 34.21 3.97 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.748 0.785 . . . . 0.0 109.708 178.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.577 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 10.8 t -98.78 -33.6 4.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.942 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.66 88.57 7.16 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 122.707 1.241 . . . . 0.0 111.665 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.756 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -166.44 -32.13 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 112.438 -2.165 . . . . 0.0 110.296 178.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.738 ' HD1' HD22 ' A' ' 34' ' ' LEU . 42.2 m-85 -71.16 -59.7 3.21 Favored Pre-proline 0 CA--C 1.531 0.241 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.556 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 73.8 Cg_endo -78.99 178.74 7.19 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.955 1.77 . . . . 0.0 111.583 179.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.518 ' HB2' ' CZ ' ' C' ' 115' ' ' PHE . 6.5 m120 -70.3 -52.07 25.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.765 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.36 -100.18 2.33 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -89.74 82.18 1.42 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.28 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.0 tp . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.424 -179.164 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 112.273 -0.331 . . . . 0.0 112.273 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.487 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 6.8 mp -59.08 -57.04 30.04 Favored Pre-proline 0 N--CA 1.465 0.294 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.487 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 1.2 Cg_endo -50.94 -34.49 46.16 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.987 2.458 . . . . 0.0 112.536 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.97 -36.22 72.44 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.697 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.401 HG11 HG23 ' A' ' 5' ' ' VAL . 79.1 t -75.03 -47.68 35.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.412 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.777 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -70.59 -20.62 62.75 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.658 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 19.3 t -68.42 -26.8 65.72 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 63.6 tp -74.32 -23.26 59.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.522 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.8 ' HA ' HG22 ' B' ' 52' ' ' VAL . 9.1 mmt85 -69.26 -22.08 63.86 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.658 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.3 mt-30 -74.4 -38.16 63.19 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.534 ' O ' HD22 ' B' ' 55' ' ' LEU . 10.1 mm100 -70.57 -32.94 70.54 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.391 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.8 HG22 ' HA ' ' B' ' 49' ' ' ARG . 28.0 m -74.73 -31.55 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.662 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.609 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 50.7 mt-10 -70.52 -30.03 66.69 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -65.25 -53.09 49.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.615 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.534 HD22 ' O ' ' B' ' 51' ' ' GLN . 3.9 mm? -57.46 -37.66 73.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.632 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.609 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 19.5 pt20 -76.4 -25.34 54.43 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.368 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.784 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -69.61 -37.43 77.46 Favored Glycine 0 C--O 1.242 0.6 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.663 178.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.686 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 69.3 mt-30 -72.53 -47.18 50.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.251 -0.475 . . . . 0.0 111.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.586 HG22 HD11 ' A' ' 22' ' ' LEU . 15.0 p -68.74 -32.57 55.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 C-N-CA 120.305 -0.558 . . . . 0.0 112.012 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.784 HE21 ' HA2' ' B' ' 57' ' ' GLY . 13.7 pt20 -68.23 -40.91 81.9 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.965 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.402 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.2 p-80 -79.18 -19.14 51.63 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.686 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.6 mt -72.33 -43.19 64.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? -70.85 -33.75 70.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.92 -56.39 22.32 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.913 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.45 -40.77 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.092 178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.413 ' O ' ' HB3' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -57.46 -26.05 60.63 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.485 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t -53.67 -26.64 23.44 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.166 0.508 . . . . 0.0 110.459 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.405 HE21 ' HB3' ' B' ' 68' ' ' GLN . 4.8 mm100 -92.29 -54.84 3.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.459 178.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.606 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 21.6 m-85 -62.03 -20.12 63.61 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' B' ' 66' ' ' PHE . 0.0 OUTLIER -67.03 -23.46 65.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.849 -179.288 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.56 ' O ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -110.82 33.14 4.74 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.621 0.724 . . . . 0.0 109.678 178.189 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.606 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 16.2 t -97.1 -34.45 4.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.206 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -89.97 89.57 7.78 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 122.549 1.166 . . . . 0.0 111.414 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.737 HD22 ' HD1' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -167.9 -30.93 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 112.486 -2.143 . . . . 0.0 110.393 178.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.737 ' HD1' HD22 ' B' ' 74' ' ' LEU . 42.0 m-85 -72.82 -58.78 2.55 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.54 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 75.7 Cg_endo -79.47 178.45 7.37 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.05 1.833 . . . . 0.0 111.814 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . 0.482 ' HB2' ' CZ ' ' A' ' 35' ' ' PHE . 7.0 m120 -70.59 -47.55 59.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.271 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.23 -102.26 2.04 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -178.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -89.39 85.03 1.41 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.25 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.437 HG23 ' HZ ' ' A' ' 35' ' ' PHE . 8.7 tp . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.731 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.735 0 N-CA-C 112.166 -0.374 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.499 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 9.5 mt -59.99 -55.6 43.95 Favored Pre-proline 0 N--CA 1.468 0.436 0 CA-C-N 116.708 0.254 . . . . 0.0 111.67 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 1.3 Cg_endo -51.64 -33.91 50.93 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 123.055 2.503 . . . . 0.0 112.757 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -72.14 -34.61 68.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.519 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 69.1 t -76.55 -47.46 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 178.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.797 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -70.5 -20.82 62.81 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 25.0 t -67.94 -27.35 66.54 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 65.8 tp -74.26 -22.8 59.16 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.761 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.803 ' HA ' HG22 ' C' ' 92' ' ' VAL . 9.0 mmt85 -69.59 -22.48 63.51 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.6 mt-30 -74.26 -37.21 63.82 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.539 ' O ' HD22 ' C' ' 95' ' ' LEU . 10.2 mm100 -71.63 -32.75 68.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.29 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.803 HG22 ' HA ' ' C' ' 89' ' ' ARG . 27.5 m -74.63 -31.83 27.97 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.609 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.584 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 49.5 mt-10 -69.72 -30.72 68.41 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -65.03 -52.98 52.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.777 -1.102 . . . . 0.0 109.706 177.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.539 HD22 ' O ' ' C' ' 91' ' ' GLN . 3.8 mm? -57.6 -37.69 73.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.696 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 19.5 pt20 -76.23 -25.15 54.76 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.318 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.793 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -69.69 -37.2 76.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 119.9 -1.143 . . . . 0.0 110.729 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.696 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 68.1 mt-30 -73.34 -46.26 50.28 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.419 . . . . 0.0 111.22 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.641 HG22 HD11 ' B' ' 62' ' ' LEU . 14.7 p -69.45 -32.47 53.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.667 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.793 HE21 ' HA2' ' C' ' 97' ' ' GLY . 15.4 pt20 -67.84 -42.17 81.83 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.866 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.421 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.1 p-80 -78.43 -18.88 54.31 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.454 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.696 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 14.3 mt -72.4 -43.59 63.69 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 177.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -70.12 -34.19 72.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 178.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.63 -55.86 28.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.24 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.8 98.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.829 179.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.405 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -57.57 -24.43 56.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.728 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 31.5 t -55.46 -26.46 42.4 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 110.391 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -92.78 -52.94 4.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.272 178.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.529 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 22.0 m-85 -63.18 -20.51 65.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.447 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 0.1 OUTLIER -66.49 -25.91 66.93 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.837 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.439 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -107.66 35.08 3.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.832 0.825 . . . . 0.0 109.949 178.783 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.529 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 12.6 t -99.42 -35.83 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.166 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.527 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 27.1 tt0 -88.92 90.46 8.42 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 122.681 1.229 . . . . 0.0 111.141 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.527 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER -167.46 -37.41 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 112.581 -2.1 . . . . 0.0 109.421 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.54 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 42.2 m-85 -67.71 -59.58 6.59 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.789 177.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.54 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 73.7 Cg_endo -79.33 -179.69 5.63 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.986 1.791 . . . . 0.0 111.565 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . 0.497 ' HB2' ' CZ ' ' B' ' 75' ' ' PHE . 6.0 m120 -72.45 -48.6 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 111.134 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.11 -100.46 2.0 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -89.1 82.7 1.46 Allowed Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 111.303 -0.719 . . . . 0.0 111.303 178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.421 HG23 ' HZ ' ' B' ' 75' ' ' PHE . 8.8 tp . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.342 -0.837 . . . . 0.0 110.454 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.794 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.502 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 60.5 mt -55.7 -53.2 65.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.947 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 77.0 Cg_exo -46.34 -46.14 17.48 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 122.803 2.335 . . . . 0.0 112.918 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.15 -33.43 73.41 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.221 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 1' ' ' GLY . 60.1 t -63.27 -55.72 21.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.82 95.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.89 0.376 . . . . 0.0 111.416 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 23.4 m -63.7 -31.03 72.07 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 122.095 0.95 . . . . 0.0 110.353 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.939 HD22 ' HB3' ' B' ' 49' ' ' ARG . 37.0 tp -75.18 -54.54 6.95 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.81 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 1.036 ' HA ' HG23 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -58.26 -28.58 65.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 123.44 0.463 . . . . 0.0 112.067 -179.024 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.7 pt20 -70.63 -42.4 70.94 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -65.63 -10.3 34.64 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.948 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 1.036 HG23 ' HA ' ' A' ' 9' ' ' ARG . 15.7 t -78.57 -38.57 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-O 120.458 0.17 . . . . 0.0 110.769 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 21.9 pt-20 -73.26 -19.17 61.12 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.9 -49.63 23.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.513 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' B' ' 56' ' ' GLN . 10.4 tp -61.71 -33.58 74.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.351 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.401 ' O ' HG12 ' A' ' 19' ' ' VAL . 1.9 tp-100 -68.53 -42.32 78.65 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.581 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.644 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.77 -30.04 71.71 Favored Glycine 0 C--O 1.236 0.235 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.543 ' HA ' ' HD1' ' A' ' 21' ' ' HIS . 73.5 mt-30 -73.31 -47.4 42.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.263 0.554 . . . . 0.0 110.834 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.519 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.1 p -69.64 -26.41 30.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.337 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 1.7 pt20 -73.6 -39.58 64.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.543 ' HD1' ' HA ' ' A' ' 18' ' ' GLN . 9.7 p-80 -80.44 -12.29 59.58 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.02 -0.672 . . . . 0.0 109.783 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.565 HD13 ' CE2' ' B' ' 66' ' ' PHE . 0.1 OUTLIER -76.01 -39.21 56.24 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 176.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 69.8 mt-30 -70.74 -31.13 67.85 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.462 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -62.24 -44.17 97.17 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.642 177.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.18 -49.67 76.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.732 178.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.45 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 6.5 m-85 -54.96 -25.71 31.54 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.984 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -51.63 -31.8 26.66 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 110.748 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.409 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 76.0 mt-30 -88.55 -54.58 4.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.371 0.605 . . . . 0.0 110.502 178.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.642 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.4 m-85 -63.74 -19.46 64.97 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.554 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 21.0 ptmt -68.91 -30.29 68.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.611 0.243 . . . . 0.0 110.883 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.622 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -102.15 28.16 6.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.899 0.857 . . . . 0.0 109.813 178.394 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.642 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 24.4 t -94.03 -44.34 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.577 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.621 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 5.6 tt0 -111.6 109.76 19.82 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 122.276 1.036 . . . . 0.0 110.065 177.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.822 HD22 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -172.29 -33.86 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 113.013 -1.903 . . . . 0.0 109.434 -179.049 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.69 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 18.1 m-85 -70.5 -53.82 9.41 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.032 177.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.69 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 84.1 Cg_endo -82.51 -177.06 3.23 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.391 2.061 . . . . 0.0 112.159 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.8 p30 -135.07 13.53 3.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.682 0.277 . . . . 0.0 111.393 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.47 -99.94 1.91 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.526 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 8.49 6.44 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.159 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.427 HD11 HG21 ' A' ' 40' ' ' ILE . 38.5 mm . . . . . 0 C--O 1.243 0.722 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.29 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.444 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.95 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.499 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 62.6 mt -56.64 -52.16 75.7 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 71.9 Cg_exo -47.32 -46.23 20.36 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 122.782 2.322 . . . . 0.0 112.679 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.25 -35.13 74.79 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 41' ' ' GLY . 58.2 t -61.88 -55.09 26.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.194 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -41.04 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 0.0 111.244 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' B' ' 50' ' ' GLN . 35.2 m -63.72 -31.38 72.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.259 1.028 . . . . 0.0 110.241 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.997 HD22 ' HB3' ' C' ' 89' ' ' ARG . 34.5 tp -75.07 -54.91 6.34 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.827 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 1.089 ' HA ' HG23 ' B' ' 52' ' ' VAL . 0.0 OUTLIER -57.61 -28.96 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.465 0.478 . . . . 0.0 111.969 -178.818 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.598 ' O ' ' HG2' ' B' ' 53' ' ' GLU . 2.6 pt20 -70.43 -42.87 71.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.59 -10.58 36.73 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.629 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 1.089 HG23 ' HA ' ' B' ' 49' ' ' ARG . 16.2 t -78.18 -37.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.961 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' B' ' 50' ' ' GLN . 22.9 pt-20 -74.08 -18.69 60.78 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -48.52 27.46 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.184 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' C' ' 95' ' ' LEU . 10.8 tp -62.66 -32.86 73.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.428 ' HA ' HD13 ' A' ' 15' ' ' LEU . 1.9 tp-100 -69.42 -42.65 74.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.577 177.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.627 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.99 -30.26 69.66 Favored Glycine 0 CA--C 1.52 0.375 0 N-CA-C 111.124 -0.791 . . . . 0.0 111.124 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.548 ' HA ' ' HD1' ' B' ' 61' ' ' HIS . 73.3 mt-30 -72.62 -48.86 36.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.341 0.591 . . . . 0.0 111.046 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.502 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 2.4 p -69.14 -26.2 31.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.254 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 1.7 pt20 -73.59 -39.48 64.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.548 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 9.5 p-80 -80.63 -11.4 59.65 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.813 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.522 HD13 ' CE2' ' C' ' 106' ' ' PHE . 0.1 OUTLIER -76.46 -38.83 54.79 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 176.132 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' B' ' 59' ' ' VAL . 70.8 mt-30 -70.76 -31.27 68.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 177.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.428 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -62.15 -44.56 96.35 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.542 177.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.82 -49.65 76.63 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.879 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.565 ' CE2' HD13 ' A' ' 22' ' ' LEU . 6.7 m-85 -55.56 -25.37 37.54 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.898 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.2 t -52.3 -31.13 31.52 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 118.045 0.384 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.416 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 76.8 mt-30 -88.56 -54.48 4.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.33 0.585 . . . . 0.0 110.621 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.648 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.9 m-85 -63.66 -20.05 65.39 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -177.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.552 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 21.1 ptmt -68.55 -30.5 69.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.645 0.26 . . . . 0.0 110.89 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.632 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.38 26.48 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.644 0.735 . . . . 0.0 110.068 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.648 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 25.0 t -92.47 -44.14 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.953 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.622 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 10.0 tt0 -112.28 109.93 19.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.32 1.057 . . . . 0.0 109.787 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.844 ' N ' HD22 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -172.31 -33.8 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.161 -178.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.668 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 18.4 m-85 -70.87 -53.85 8.4 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.244 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.668 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 71.9 Cg_endo -82.03 -176.14 2.86 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.3 2.0 . . . . 0.0 112.143 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 18.3 p30 -135.46 12.22 3.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.176 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.54 -99.43 1.84 Allowed Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.31 6.35 6.87 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.199 -1.0 . . . . 0.0 113.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm . . . . . 0 C--O 1.243 0.729 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.13 179.712 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.418 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.898 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.462 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 67.8 mt -57.07 -53.92 60.06 Favored Pre-proline 0 N--CA 1.465 0.296 0 CA-C-O 119.174 -0.441 . . . . 0.0 111.733 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.462 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 71.0 Cg_exo -45.48 -45.42 15.81 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.617 2.212 . . . . 0.0 112.674 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -33.19 73.54 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.299 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.418 HG23 ' O ' ' C' ' 81' ' ' GLY . 66.4 t -63.54 -56.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.426 0.453 . . . . 0.0 110.863 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' C' ' 90' ' ' GLN . . . -63.85 -43.31 96.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 110.97 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 40.6 m -62.47 -30.58 71.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.937 0.875 . . . . 0.0 110.649 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.957 HD22 ' HB3' ' A' ' 9' ' ' ARG . 32.8 tp -76.85 -53.53 7.78 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.778 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 1.087 ' HA ' HG23 ' C' ' 92' ' ' VAL . 0.0 OUTLIER -57.83 -29.52 65.01 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.528 0.518 . . . . 0.0 111.708 -179.033 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.598 ' O ' ' HG2' ' C' ' 93' ' ' GLU . 2.9 pt20 -69.72 -43.28 72.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 176.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 71.9 mt-30 -64.42 -11.82 37.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.915 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 1.087 HG23 ' HA ' ' C' ' 89' ' ' ARG . 17.2 t -77.36 -38.85 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 O-C-N 122.346 -0.221 . . . . 0.0 111.141 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' C' ' 90' ' ' GLN . 21.8 pt-20 -73.51 -17.21 61.24 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.455 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -74.86 -49.38 20.7 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.35 177.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.536 ' HB3' HD21 ' B' ' 55' ' ' LEU . 3.3 mt -59.76 -37.1 78.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.617 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.503 ' O ' HG22 ' C' ' 99' ' ' VAL . 2.0 tp-100 -66.07 -40.81 91.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.622 179.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.609 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -61.38 -30.28 73.81 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.558 ' HA ' ' HD1' ' C' ' 101' ' ' HIS . 73.4 mt-30 -73.59 -47.86 37.14 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.751 -0.264 . . . . 0.0 110.578 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.503 HG22 ' O ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -65.9 -32.31 57.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.389 179.334 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 1.7 pt20 -68.36 -39.73 81.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -178.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.558 ' HD1' ' HA ' ' C' ' 98' ' ' GLN . 13.0 p-80 -81.43 -10.54 59.49 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.795 178.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.486 ' CD2' ' HB3' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -81.4 -33.5 32.19 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' C' ' 99' ' ' VAL . 71.5 mt-30 -74.45 -29.52 61.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 175.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.446 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -62.99 -44.91 94.72 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.478 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.92 -49.99 75.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.688 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.522 ' CE2' HD13 ' B' ' 62' ' ' LEU . 6.5 m-85 -55.04 -25.73 32.56 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.092 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.6 t -51.69 -30.47 22.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.105 0.411 . . . . 0.0 110.594 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.426 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 77.0 mt-30 -89.66 -54.6 3.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.556 0.693 . . . . 0.0 110.678 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.641 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -63.46 -20.2 65.38 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.985 -1.007 . . . . 0.0 113.56 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.558 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 21.3 ptmt -68.37 -30.03 68.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 111.154 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.621 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.99 27.04 6.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.693 0.759 . . . . 0.0 109.924 178.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.641 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 24.9 t -92.94 -44.22 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.903 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.632 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 6.2 tt0 -112.31 109.54 19.24 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.164 0.983 . . . . 0.0 109.838 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.812 ' N ' HD22 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -171.87 -34.61 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 113.033 -1.894 . . . . 0.0 108.977 -178.66 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.648 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 17.0 m-85 -70.39 -54.17 9.27 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.27 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.648 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 81.6 Cg_endo -82.33 -178.93 4.3 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.223 1.949 . . . . 0.0 112.147 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -132.13 11.93 4.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.149 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 102.87 -100.62 1.98 Allowed Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 126.44 6.16 5.78 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.135 -1.031 . . . . 0.0 112.957 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.406 HD11 HG21 ' C' ' 120' ' ' ILE . 40.1 mm . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.4 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.927 0 N-CA-C 112.078 -0.409 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.492 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 3.4 mm? -61.46 -54.6 50.94 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.061 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.492 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 74.9 Cg_exo -44.35 -42.82 13.71 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.965 2.443 . . . . 0.0 113.125 -178.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -63.12 -34.3 77.31 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.133 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -59.52 -54.75 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.437 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.78 -37.38 86.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.894 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.744 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -65.96 -22.9 66.5 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.585 0.707 . . . . 0.0 109.899 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.739 ' O ' HG22 ' A' ' 12' ' ' VAL . 52.7 tp -75.91 -30.57 58.8 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.231 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.506 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mmm-85 -62.88 -39.62 95.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.744 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.48 -37.21 79.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.59 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.48 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 82.7 mt-30 -64.24 -30.0 71.07 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.213 0.53 . . . . 0.0 109.868 178.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.739 HG22 ' O ' ' A' ' 8' ' ' LEU . 83.4 t -72.68 -40.27 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HA ' HE21 ' A' ' 16' ' ' GLN . 13.8 tp10 -63.25 -33.99 76.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 122.159 0.981 . . . . 0.0 108.779 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 11' ' ' GLN . . . -64.01 -61.29 2.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.087 -1.415 . . . . 0.0 111.268 178.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.479 HD22 HG11 ' B' ' 59' ' ' VAL . 2.6 tm? -59.51 -38.87 82.08 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.416 -1.266 . . . . 0.0 111.662 -178.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.495 HE21 ' HA ' ' A' ' 13' ' ' GLU . 22.5 pt20 -70.77 -23.32 62.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.436 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.651 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.36 -27.55 73.54 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.035 -1.078 . . . . 0.0 110.44 177.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.712 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 80.1 mm-40 -75.04 -48.12 25.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.086 0.47 . . . . 0.0 110.71 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.478 HG11 HD22 ' C' ' 95' ' ' LEU . 2.4 p -67.97 -33.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.817 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.651 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 11.2 pt20 -66.32 -43.92 84.85 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.877 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.496 ' N ' ' HG3' ' A' ' 20' ' ' GLN . 7.8 p-80 -76.34 -16.08 59.83 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.747 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.712 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.9 mt -73.3 -36.93 66.36 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.694 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.8 tm0? -70.99 -33.98 70.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -58.41 -51.91 67.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.704 177.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.58 -38.6 90.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.507 178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.434 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -55.7 -30.03 60.41 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.369 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 t -49.22 -27.3 3.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.993 0.425 . . . . 0.0 111.13 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -96.04 -45.61 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.539 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 22.4 m-85 -68.42 -21.51 64.66 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.464 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 45.9 mtpt -71.21 -28.68 64.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.721 0.295 . . . . 0.0 111.159 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.454 ' O ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -100.17 30.31 3.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.665 0.745 . . . . 0.0 109.677 178.592 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.539 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 13.0 t -95.66 -42.56 12.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.952 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.528 ' HB2' HG22 ' C' ' 112' ' ' VAL . 18.9 tt0 -103.44 101.87 11.77 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.086 0.946 . . . . 0.0 111.034 178.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.81 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -175.7 -33.41 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 112.905 -1.952 . . . . 0.0 110.291 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.507 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -117.22 -9.91 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.204 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 178.783 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.505 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 66.8 Cg_endo -84.86 167.51 11.18 Favored 'Trans proline' 0 C--N 1.366 1.478 0 CA-C-N 122.305 1.859 . . . . 0.0 113.382 -178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -132.84 175.13 9.61 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.162 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -89.71 125.36 7.81 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.107 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -96.19 17.69 58.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.279 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.411 HD13 ' HA ' ' C' ' 115' ' ' PHE . 35.8 mt . . . . . 0 C--O 1.243 0.758 0 CA-C-O 118.607 -0.711 . . . . 0.0 109.967 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.484 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 3.4 mm? -61.22 -54.3 54.72 Favored Pre-proline 0 N--CA 1.469 0.506 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.226 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.484 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.9 Cg_exo -44.34 -42.27 13.63 Favored 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 123.044 2.496 . . . . 0.0 113.079 -178.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -63.66 -34.82 78.69 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.308 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 87.1 t -58.83 -55.04 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.475 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -65.72 -37.55 86.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.195 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.728 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 51.1 m -66.25 -22.29 66.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.641 0.734 . . . . 0.0 109.76 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.731 ' O ' HG22 ' B' ' 52' ' ' VAL . 50.6 tp -75.93 -31.12 58.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.321 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.497 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 16.7 mmm-85 -62.75 -39.74 95.08 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.728 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -68.0 -37.72 81.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.717 178.657 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.497 ' O ' ' HB1' ' B' ' 54' ' ' ALA . 82.3 mt-30 -63.99 -30.21 71.3 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.459 0.647 . . . . 0.0 109.889 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.731 HG22 ' O ' ' B' ' 48' ' ' LEU . 77.6 t -71.72 -41.48 70.71 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.046 179.211 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.519 ' HA ' HE21 ' B' ' 56' ' ' GLN . 15.1 tp10 -62.04 -33.57 74.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.218 1.009 . . . . 0.0 108.93 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.497 ' HB1' ' O ' ' B' ' 51' ' ' GLN . . . -64.71 -60.67 2.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.465 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.99 -38.87 83.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.568 -1.197 . . . . 0.0 111.571 -178.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.519 HE21 ' HA ' ' B' ' 53' ' ' GLU . 22.3 pt20 -70.27 -24.41 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.384 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.645 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -66.99 -26.7 73.27 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 119.924 -1.131 . . . . 0.0 110.441 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.706 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 80.9 mm-40 -75.86 -48.6 20.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.317 0.58 . . . . 0.0 110.72 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.479 HG11 HD22 ' A' ' 15' ' ' LEU . 2.4 p -67.93 -31.69 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.687 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.645 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.7 pt20 -67.74 -43.67 79.38 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.785 178.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.521 ' N ' ' HG3' ' B' ' 60' ' ' GLN . 7.7 p-80 -76.47 -14.92 60.01 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 119.51 -0.876 . . . . 0.0 110.657 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.729 HD21 ' HG2' ' C' ' 103' ' ' GLN . 14.6 mt -74.57 -37.9 62.83 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 176.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.71 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.1 tm0? -70.29 -33.8 71.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 177.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -58.46 -51.0 71.71 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.787 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -38.84 92.51 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.572 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.428 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.3 OUTLIER -56.07 -29.55 60.69 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.269 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -50.07 -26.37 4.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.082 0.468 . . . . 0.0 110.841 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -96.34 -46.29 6.46 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.621 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.549 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 21.6 m-85 -68.54 -21.14 64.57 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.446 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 48.0 mtpt -71.63 -27.3 63.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.744 0.307 . . . . 0.0 110.982 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.464 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.66 30.9 4.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.724 0.773 . . . . 0.0 109.649 178.209 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.549 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 12.6 t -96.24 -42.94 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.794 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.47 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 20.3 tt0 -103.32 101.74 11.68 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.13 0.967 . . . . 0.0 111.252 178.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.781 HD23 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER -176.32 -33.13 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 112.863 -1.971 . . . . 0.0 110.257 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.507 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -117.32 -9.43 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.989 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 178.622 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 63.6 Cg_endo -85.75 168.0 9.73 Favored 'Trans proline' 0 C--N 1.366 1.494 0 CA-C-N 122.572 1.954 . . . . 0.0 113.191 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -132.86 175.3 9.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.433 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.51 125.41 7.81 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.213 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 15.93 62.19 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.189 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.53 HD12 HG22 ' B' ' 80' ' ' ILE . 25.5 mt . . . . . 0 C--O 1.244 0.786 0 CA-C-O 118.462 -0.78 . . . . 0.0 109.735 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.533 0 N-CA-C 112.066 -0.414 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . . . . . . . . . 1.3 mt -65.95 -52.83 38.21 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.02 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_exo -44.03 -41.09 12.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.66 2.24 . . . . 0.0 112.58 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -64.21 -35.09 79.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.144 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 98.6 t -58.12 -55.41 22.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.693 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.431 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.73 -37.1 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.94 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.755 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 49.1 m -66.82 -23.18 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.476 0.655 . . . . 0.0 109.653 178.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.477 ' O ' HG12 ' C' ' 92' ' ' VAL . 49.3 tp -73.96 -32.06 63.3 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.851 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.467 ' HA ' ' CG1' ' C' ' 92' ' ' VAL . 13.3 mmm-85 -63.27 -37.97 89.33 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.755 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.56 -36.74 79.18 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' C' ' 87' ' ' SER . 81.8 mt-30 -64.13 -33.14 75.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.128 177.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.477 HG12 ' O ' ' C' ' 88' ' ' LEU . 0.5 OUTLIER -75.11 -31.89 25.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.942 179.576 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.513 ' HA ' HE21 ' C' ' 96' ' ' GLN . 15.8 tp10 -64.64 -36.33 83.91 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -63.35 -59.75 4.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.522 -1.217 . . . . 0.0 111.322 178.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.478 HD22 HG11 ' A' ' 19' ' ' VAL . 2.5 tm? -58.93 -40.21 83.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.551 -178.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.679 ' HA ' HG22 ' C' ' 99' ' ' VAL . 20.8 pt20 -69.35 -24.3 63.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.483 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.692 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -66.13 -28.18 73.49 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.356 -1.097 . . . . 0.0 110.356 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.704 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 78.8 mm-40 -74.43 -46.27 41.06 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.414 178.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.679 HG22 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.01 -41.69 93.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.421 -0.511 . . . . 0.0 111.169 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.692 HE21 ' HA2' ' C' ' 97' ' ' GLY . 14.5 pt20 -61.87 -43.15 99.43 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.031 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.545 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.2 p-80 -78.55 -14.85 59.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.774 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.704 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.3 mt -74.21 -37.91 63.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.2 tm0? -71.08 -34.19 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.411 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -58.13 -51.51 69.42 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.396 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.09 -38.14 90.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.804 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.553 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 1.0 OUTLIER -56.32 -29.67 61.59 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 123.451 0.469 . . . . 0.0 111.016 178.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 29.6 t -48.37 -26.94 2.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.107 0.48 . . . . 0.0 111.024 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.402 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 13.7 mm100 -96.98 -46.5 6.18 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.909 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.54 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 21.5 m-85 -68.48 -20.57 64.61 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.553 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 44.3 mtpt -72.11 -28.1 63.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.48 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -101.33 31.51 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.832 0.825 . . . . 0.0 109.84 178.157 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.54 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -96.49 -42.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.956 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.52 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 20.6 tt0 -103.04 100.85 10.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.287 1.042 . . . . 0.0 111.306 178.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.52 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER -173.21 -37.5 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 112.794 -2.003 . . . . 0.0 109.847 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.5 ' N ' ' CD ' ' C' ' 116' ' ' PRO . 0.2 OUTLIER -114.99 -9.96 0.1 OUTLIER Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -179.659 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 67.7 Cg_endo -84.47 168.02 11.61 Favored 'Trans proline' 0 C--N 1.359 1.121 0 CA-C-N 122.512 1.933 . . . . 0.0 113.269 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -133.4 175.36 9.48 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.399 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -89.77 123.22 6.84 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.348 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -92.77 11.3 72.41 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.673 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.465 HG22 HD12 ' C' ' 120' ' ' ILE . 26.3 mt . . . . . 0 C--O 1.243 0.718 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.01 179.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.457 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.986 0 N-CA-C 112.464 -0.255 . . . . 0.0 112.464 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.475 HD11 ' HA ' ' A' ' 2' ' ' LEU . 3.8 mm? -58.96 -55.08 50.1 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-O 119.253 -0.404 . . . . 0.0 111.788 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -44.17 -44.47 12.61 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 122.878 2.385 . . . . 0.0 112.89 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -37.55 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.249 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 1' ' ' GLY . 61.4 t -64.04 -47.86 88.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.464 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.431 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -68.41 -29.29 67.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.752 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.598 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 49.2 m -70.02 -22.51 63.09 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.949 0.88 . . . . 0.0 109.391 178.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.2 tp -76.8 -21.72 54.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.513 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.581 ' HA ' HG12 ' A' ' 12' ' ' VAL . 7.9 mmm180 -67.56 -33.9 75.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -71.7 -47.12 56.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 179.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.416 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 7.6 tt0 -64.53 -27.75 69.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.281 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.581 HG12 ' HA ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -77.64 -36.92 23.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.766 -178.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.528 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.7 mt-10 -69.99 -28.6 65.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.29 -50.93 63.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.341 178.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' B' ' 56' ' ' GLN . 28.0 tp -60.79 -39.13 87.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.124 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.548 ' HA ' HG23 ' A' ' 19' ' ' VAL . 16.1 pt20 -71.42 -23.45 61.86 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.325 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.592 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.34 -28.36 73.31 Favored Glycine 0 C--O 1.24 0.521 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.441 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.664 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.3 mm-40 -73.65 -42.77 60.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.98 0.419 . . . . 0.0 110.005 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.548 HG23 ' HA ' ' A' ' 16' ' ' GLN . 3.4 t -65.94 -42.58 92.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.159 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.592 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.6 pt20 -62.33 -41.44 98.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.539 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.496 ' HA ' ' HB1' ' A' ' 24' ' ' ALA . 6.9 p-80 -79.26 -17.38 54.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.806 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.703 HD22 ' HB3' ' B' ' 63' ' ' GLN . 7.3 mt -71.95 -47.57 51.38 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.729 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 13.2 pt20 -71.36 -22.7 61.86 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.496 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -62.21 -51.3 68.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.64 99.63 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.548 177.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.729 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -52.03 -29.13 19.73 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.692 178.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.4 t -47.67 -33.47 6.89 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.008 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.848 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 69.6 mt-30 -86.73 -51.51 6.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.457 0.646 . . . . 0.0 110.884 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.634 ' HA ' HG23 ' A' ' 32' ' ' VAL . 15.3 m-85 -63.94 -21.31 66.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.29 -0.868 . . . . 0.0 113.167 -177.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.459 ' HD2' ' CE2' ' C' ' 109' ' ' TYR . 10.4 mmmm -64.63 -32.2 73.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.963 0.411 . . . . 0.0 110.51 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.848 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -108.52 35.91 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.095 0.474 . . . . 0.0 110.763 179.394 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.634 HG23 ' HA ' ' A' ' 29' ' ' TYR . 5.9 t -95.66 -43.59 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.575 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -104.52 102.35 11.98 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 122.084 0.945 . . . . 0.0 110.551 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.794 ' N ' HD21 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -175.12 -39.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 113.041 -1.89 . . . . 0.0 111.288 -179.254 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.668 ' CD2' HD23 ' A' ' 34' ' ' LEU . 4.7 p90 -98.08 -25.73 0.24 Allowed Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.539 ' HD2' ' H ' ' A' ' 34' ' ' LEU . 72.8 Cg_endo -82.3 -177.46 3.49 Favored 'Trans proline' 0 C--N 1.364 1.365 0 CA-C-N 121.169 1.453 . . . . 0.0 112.676 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -140.67 164.34 30.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.381 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.7 124.79 3.74 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.094 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.13 -99.81 2.52 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.76 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.277 179.261 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.485 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.067 -0.413 . . . . 0.0 112.067 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.469 ' HA ' HD11 ' B' ' 42' ' ' LEU . 3.8 mm? -61.04 -54.81 50.55 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-O 119.198 -0.43 . . . . 0.0 111.467 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -44.17 -45.01 12.4 Favored 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 122.987 2.458 . . . . 0.0 112.906 -179.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -61.86 -35.62 78.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.14 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 41' ' ' GLY . 60.8 t -65.47 -48.92 81.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.335 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.447 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.53 -29.35 68.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.788 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.626 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.6 m -69.28 -23.97 63.9 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.715 0.769 . . . . 0.0 109.461 178.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.5 tp -76.0 -21.96 56.34 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.642 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.601 ' HA ' HG12 ' B' ' 52' ' ' VAL . 8.2 mmm180 -67.07 -33.96 76.64 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -71.68 -47.0 57.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.861 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 7.7 tt0 -64.56 -28.11 69.41 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.062 179.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.601 HG12 ' HA ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -76.95 -36.82 25.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.953 -178.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.549 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 47.8 mt-10 -70.57 -28.1 64.64 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 122.017 0.913 . . . . 0.0 108.551 176.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -65.22 -51.58 60.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.07 177.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.491 HD11 HG12 ' C' ' 99' ' ' VAL . 25.9 tp -60.19 -40.13 88.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.25 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.549 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.9 pt20 -70.68 -23.29 62.46 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.438 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.578 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.43 -29.1 72.96 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.657 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.5 mm100 -73.01 -42.44 63.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.112 0.482 . . . . 0.0 110.062 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.528 HG23 ' HA ' ' B' ' 56' ' ' GLN . 3.5 t -66.62 -42.11 89.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.344 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.578 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.2 pt20 -62.41 -41.85 98.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.07 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.486 ' O ' ' HB1' ' B' ' 64' ' ' ALA . 6.7 p-80 -78.76 -17.23 56.13 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.137 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.692 HD22 ' HB3' ' C' ' 103' ' ' GLN . 7.5 mt -72.98 -46.5 51.93 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.754 ' HA ' ' HB2' ' B' ' 66' ' ' PHE . 12.7 pt20 -71.76 -22.14 61.64 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -62.42 -51.44 67.51 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.34 -41.68 98.9 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.498 177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.754 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -51.94 -29.28 19.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.517 179.058 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 41.8 t -47.89 -34.71 9.3 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.862 0.363 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.843 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 66.9 mt-30 -85.45 -50.54 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.2 0.524 . . . . 0.0 110.841 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.665 ' HA ' HG23 ' B' ' 72' ' ' VAL . 15.9 m-85 -64.89 -20.62 66.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.431 ' HD2' ' CE2' ' A' ' 29' ' ' TYR . 10.2 mmmm -65.05 -32.24 73.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.117 0.484 . . . . 0.0 110.419 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.843 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -108.07 36.74 2.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.6 0.714 . . . . 0.0 110.637 179.08 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.665 HG23 ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -96.51 -43.2 12.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.549 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -105.11 100.83 10.41 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.031 0.92 . . . . 0.0 110.866 178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.775 ' N ' HD21 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -173.11 -39.97 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.404 -1.726 . . . . 0.0 111.29 -179.568 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.654 ' CD2' HD23 ' B' ' 74' ' ' LEU . 4.9 p90 -97.33 -24.52 0.23 Allowed Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 178.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.521 ' HD2' ' H ' ' B' ' 74' ' ' LEU . 72.8 Cg_endo -83.03 -177.59 3.41 Favored 'Trans proline' 0 C--N 1.366 1.451 0 CA-C-N 121.317 1.506 . . . . 0.0 112.887 -179.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.84 161.49 37.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.44 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -130.33 127.36 5.27 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.823 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 92.33 -99.97 2.61 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.121 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.444 -0.789 . . . . 0.0 110.422 179.439 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.464 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.488 2.122 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.499 HD11 ' HA ' ' C' ' 82' ' ' LEU . 3.8 mm? -60.67 -54.77 51.38 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 119.334 -0.365 . . . . 0.0 111.46 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_exo -43.76 -44.72 11.43 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 123.033 2.489 . . . . 0.0 112.913 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -62.14 -36.47 81.89 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.354 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.464 HG23 ' O ' ' C' ' 81' ' ' GLY . 73.7 t -65.03 -48.12 85.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.205 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.42 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.18 -29.84 68.81 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.832 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.621 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.1 m -69.19 -22.76 63.88 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.874 0.845 . . . . 0.0 109.22 178.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.586 ' O ' HG22 ' C' ' 92' ' ' VAL . 67.1 tp -76.15 -23.02 54.78 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.713 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.539 ' HA ' ' CG2' ' C' ' 92' ' ' VAL . 8.5 mmm180 -67.51 -31.88 72.31 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.664 0.745 . . . . 0.0 109.032 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.621 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -72.51 -45.2 60.51 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.482 -0.781 . . . . 0.0 108.949 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 7.8 tt0 -65.07 -29.31 70.18 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.257 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.586 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.14 -42.18 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.91 179.181 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.515 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.1 mt-10 -65.0 -29.52 70.45 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -65.13 -52.89 52.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.408 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 16' ' ' GLN . 28.4 tp -60.22 -39.93 88.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.325 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.561 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 18.1 pt20 -71.92 -22.29 61.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.408 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.596 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -69.59 -27.83 72.95 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.637 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 11.2 mm100 -74.63 -44.62 49.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.162 0.506 . . . . 0.0 110.413 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.561 ' CG1' ' HA ' ' C' ' 96' ' ' GLN . 0.1 OUTLIER -70.74 -31.96 47.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.124 -179.077 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.596 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.8 pt20 -67.04 -42.45 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.707 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.488 ' O ' ' HB1' ' C' ' 104' ' ' ALA . 7.6 p-80 -77.45 -17.53 58.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.234 -0.986 . . . . 0.0 110.592 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.722 HD22 ' HB3' ' A' ' 23' ' ' GLN . 8.4 mt -71.81 -47.06 55.9 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.712 ' HA ' ' HB2' ' C' ' 106' ' ' PHE . 14.3 pt20 -70.99 -22.75 62.14 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.488 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -61.68 -51.99 66.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.64 98.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.712 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -51.77 -29.32 18.42 Favored 'General case' 0 C--O 1.214 -0.781 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.411 178.874 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 46.4 t -47.75 -34.67 8.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.831 0.348 . . . . 0.0 111.124 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.838 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 69.4 mt-30 -85.23 -50.99 6.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.51 0.672 . . . . 0.0 110.665 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.694 ' HA ' HG23 ' C' ' 112' ' ' VAL . 16.1 m-85 -64.5 -21.58 66.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.136 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.474 ' HD2' ' CE2' ' B' ' 69' ' ' TYR . 10.4 mmmm -65.16 -30.25 71.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.442 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.838 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -109.75 36.94 2.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.523 0.678 . . . . 0.0 110.446 179.204 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.694 HG23 ' HA ' ' C' ' 109' ' ' TYR . 5.8 t -97.22 -43.72 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.663 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.49 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 35.8 tt0 -104.73 100.66 10.3 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.252 1.025 . . . . 0.0 110.725 179.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.544 HD21 ' HA ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER -170.51 -46.1 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.491 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.467 ' N ' ' CD ' ' C' ' 116' ' ' PRO . 4.3 p90 -92.83 -25.67 0.27 Allowed Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.503 ' HD2' ' H ' ' C' ' 114' ' ' LEU . 78.5 Cg_endo -82.71 -177.5 3.43 Favored 'Trans proline' 0 C--N 1.36 1.169 0 CA-C-N 121.516 1.577 . . . . 0.0 112.822 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.38 162.17 36.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.614 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -130.86 124.07 4.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.259 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 94.79 -100.48 2.58 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.855 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.61 179.081 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.423 ' O ' HG21 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.965 0 N-CA-C 111.819 -0.512 . . . . 0.0 111.819 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.628 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 3.5 mm? -100.95 -55.25 0.14 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 119.713 -0.184 . . . . 0.0 111.297 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.628 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 6.2 Cg_exo -46.13 -45.31 18.27 Favored 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.29 2.66 . . . . 0.0 113.567 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -64.79 -27.34 68.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.816 -0.175 . . . . 0.0 111.203 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.444 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 74.4 t -70.49 -46.2 71.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.637 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -71.22 -24.81 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.122 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -73.49 -18.58 61.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.67 0.748 . . . . 0.0 109.618 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.48 HD22 HD22 ' B' ' 48' ' ' LEU . 60.0 tp -79.03 -18.81 52.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.637 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -70.79 -44.33 66.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.219 177.856 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.2 pt20 -70.8 -33.91 71.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.007 0.432 . . . . 0.0 109.946 178.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.9 tt0 -69.86 -31.22 68.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.457 0.646 . . . . 0.0 110.391 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.453 HG11 ' N ' ' A' ' 13' ' ' GLU . 1.4 p -79.3 -31.47 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.154 -179.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 46.3 mt-10 -76.06 -20.47 57.72 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.06 -51.62 30.51 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.284 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.457 HD13 ' HA ' ' B' ' 56' ' ' GLN . 25.0 tp -63.16 -30.48 71.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.972 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -64.4 -40.49 95.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.53 177.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.644 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -63.44 -27.39 70.75 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.424 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.643 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.6 mm100 -71.51 -42.34 68.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.947 0.403 . . . . 0.0 110.047 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.513 HG12 ' HB3' ' C' ' 98' ' ' GLN . 2.4 t -70.88 -37.61 69.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.775 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.644 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 15.3 pt20 -64.37 -40.99 96.93 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.818 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.53 ' O ' ' HB2' ' A' ' 24' ' ' ALA . 7.7 p-80 -80.12 -17.48 52.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.316 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.0 mt -71.43 -38.44 71.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.47 ' HG2' HD23 ' C' ' 102' ' ' LEU . 66.6 mt-30 -73.78 -27.5 61.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.53 ' HB2' ' O ' ' A' ' 21' ' ' HIS . . . -59.7 -56.79 17.42 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.099 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.592 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.33 -43.89 97.76 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.142 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.436 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -53.42 -26.09 18.47 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.975 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -53.98 -36.89 63.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 111.446 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 24.7 pt20 -87.45 -36.48 17.67 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.103 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.743 ' OH ' ' HD2' ' B' ' 70' ' ' LYS . 26.5 m-85 -73.66 -20.41 60.57 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.439 0.638 . . . . 0.0 110.906 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.691 ' HD2' ' OH ' ' C' ' 109' ' ' TYR . 35.2 tptt -64.56 -40.32 95.35 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.172 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.615 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -95.38 31.48 1.96 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.684 0.754 . . . . 0.0 110.524 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.532 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 9.4 t -95.45 -41.27 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.062 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.541 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 16.8 tt0 -102.62 103.45 13.74 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 122.177 0.989 . . . . 0.0 110.464 178.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.795 HD23 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -171.8 -32.38 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 112.942 -1.935 . . . . 0.0 110.292 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.507 ' N ' ' HD3' ' A' ' 36' ' ' PRO . 0.1 OUTLIER -124.59 23.29 0.11 Allowed Pre-proline 0 CA--C 1.554 1.124 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 177.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.642 ' HD3' ' H ' ' A' ' 34' ' ' LEU . 61.8 Cg_endo -89.34 -168.16 0.31 Allowed 'Trans proline' 0 C--N 1.367 1.536 0 CA-C-N 121.472 1.561 . . . . 0.0 113.037 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -90.73 28.9 1.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.168 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.18 136.55 17.65 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.143 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.69 132.69 11.06 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.161 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.436 HG21 HD13 ' A' ' 40' ' ' ILE . 10.3 tt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.484 -0.769 . . . . 0.0 110.093 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.495 ' O ' HG21 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.597 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 3.5 mm? -97.11 -54.06 0.21 Allowed Pre-proline 0 N--CA 1.466 0.371 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.597 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 5.1 Cg_exo -47.12 -44.78 22.94 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.278 2.652 . . . . 0.0 113.517 -177.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -66.16 -25.03 66.76 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.472 0.177 . . . . 0.0 111.292 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.495 HG21 ' O ' ' B' ' 41' ' ' GLY . 82.2 t -72.15 -46.06 59.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.64 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -71.29 -23.92 62.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.025 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.622 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.9 m -74.52 -18.56 60.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.6 0.714 . . . . 0.0 109.74 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.48 HD22 HD22 ' A' ' 8' ' ' LEU . 61.3 tp -79.36 -18.27 52.79 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.64 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 0.2 OUTLIER -70.75 -44.27 67.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.212 177.773 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.622 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.4 pt20 -70.91 -34.84 71.95 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.444 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 40.1 tt0 -68.88 -30.79 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.565 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' B' ' 49' ' ' ARG . 1.5 p -79.67 -32.23 14.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.233 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 46.1 mt-10 -75.54 -20.17 58.86 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.13 -51.88 27.96 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.156 177.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' C' ' 96' ' ' GLN . 23.0 tp -63.09 -30.29 71.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.989 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.457 ' HA ' HD13 ' A' ' 15' ' ' LEU . 11.7 tt0 -64.0 -39.83 94.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.572 177.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.635 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -64.39 -26.89 71.0 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.733 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.65 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.2 mm100 -72.03 -42.7 66.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.062 0.458 . . . . 0.0 110.0 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.532 HG12 ' HB3' ' A' ' 18' ' ' GLN . 2.4 t -69.97 -37.96 74.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.782 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.635 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -64.53 -41.76 96.17 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.013 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.539 ' O ' ' HB2' ' B' ' 64' ' ' ALA . 7.9 p-80 -78.9 -17.32 55.74 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.328 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.0 mt -71.88 -38.43 70.02 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.479 ' HG2' HD23 ' A' ' 22' ' ' LEU . 63.9 mt-30 -73.98 -26.51 60.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' B' ' 61' ' ' HIS . . . -61.07 -55.96 26.5 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.09 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.603 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -62.82 -44.98 94.72 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.042 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -52.46 -25.94 11.46 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.893 179.211 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 28.2 t -54.61 -35.62 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.748 0.249 . . . . 0.0 111.44 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' B' ' 65' ' ' ALA . 24.0 pt20 -88.74 -36.4 16.15 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.039 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.742 ' OH ' ' HD2' ' C' ' 110' ' ' LYS . 27.0 m-85 -73.79 -19.96 60.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.304 0.573 . . . . 0.0 110.761 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.743 ' HD2' ' OH ' ' A' ' 29' ' ' TYR . 32.8 tptt -64.55 -41.23 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.933 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.598 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -94.53 31.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.433 0.635 . . . . 0.0 110.775 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.536 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 9.3 t -95.17 -41.68 12.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.931 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.615 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 15.1 tt0 -102.46 103.41 13.79 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 122.24 1.019 . . . . 0.0 110.658 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.753 HD23 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER -171.63 -33.04 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 112.811 -1.995 . . . . 0.0 110.114 -179.687 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.49 ' N ' ' CD ' ' B' ' 76' ' ' PRO . 0.1 OUTLIER -123.79 23.39 0.11 Allowed Pre-proline 0 CA--C 1.552 1.045 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.645 ' HD3' ' H ' ' B' ' 74' ' ' LEU . 54.9 Cg_endo -89.06 -167.39 0.28 Allowed 'Trans proline' 0 C--N 1.364 1.388 0 CA-C-N 121.759 1.664 . . . . 0.0 113.052 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -91.01 27.63 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.264 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.94 134.18 13.57 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.447 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -100.22 134.85 11.85 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.124 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.409 HG21 HD13 ' B' ' 80' ' ' ILE . 10.1 tt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.948 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.474 ' O ' HG21 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.592 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 3.4 mm? -97.92 -55.22 0.19 Allowed Pre-proline 0 C--N 1.324 -0.532 0 O-C-N 122.843 -0.21 . . . . 0.0 111.546 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.592 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 6.8 Cg_exo -46.04 -43.85 19.8 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.229 2.619 . . . . 0.0 113.859 -178.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -66.2 -26.82 67.58 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.474 HG21 ' O ' ' C' ' 81' ' ' GLY . 84.9 t -70.93 -46.22 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.616 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -71.84 -24.01 61.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.265 178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 71.1 m -74.9 -18.57 60.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.743 0.783 . . . . 0.0 109.25 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.501 ' O ' HG22 ' C' ' 92' ' ' VAL . 57.0 tp -77.63 -19.3 55.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.732 ' O ' HG21 ' C' ' 92' ' ' VAL . 0.2 OUTLIER -71.32 -42.71 68.24 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.649 178.272 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 pt20 -70.95 -33.52 70.55 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.5 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 38.8 tt0 -68.82 -33.49 73.92 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.238 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.732 HG21 ' O ' ' C' ' 89' ' ' ARG . 0.0 OUTLIER -73.82 -38.52 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.913 178.243 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.537 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 42.0 mt-10 -68.49 -21.56 64.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.96 -52.54 23.55 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.208 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.66 -33.52 72.94 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.944 178.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.419 ' HA ' HD13 ' B' ' 55' ' ' LEU . 12.8 tt0 -62.66 -40.38 96.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.899 179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.541 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -64.87 -27.19 71.81 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.481 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.646 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.2 mm100 -71.58 -42.77 67.38 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 178.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.507 HG12 ' HB3' ' B' ' 58' ' ' GLN . 2.5 t -70.73 -37.17 67.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.541 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.3 pt20 -65.25 -40.74 94.39 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.616 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.559 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.6 p-80 -80.42 -17.5 51.6 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.296 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.646 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 7.2 mt -71.13 -38.53 72.28 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.484 ' HG2' HD23 ' B' ' 62' ' ' LEU . 63.2 mt-30 -73.87 -27.21 60.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.54 ' HB2' ' O ' ' C' ' 101' ' ' HIS . . . -59.51 -56.96 15.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.299 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.588 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -62.16 -44.45 96.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.155 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -52.92 -26.88 16.36 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.022 179.461 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 34.4 t -53.14 -37.84 62.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.684 0.278 . . . . 0.0 111.194 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.591 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 25.1 pt20 -87.0 -35.9 18.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.368 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.691 ' OH ' ' HD2' ' A' ' 30' ' ' LYS . 28.7 m-85 -74.21 -19.93 60.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.361 0.6 . . . . 0.0 110.85 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.742 ' HD2' ' OH ' ' B' ' 69' ' ' TYR . 32.0 tptt -64.67 -40.8 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.994 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -95.06 31.71 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.481 0.658 . . . . 0.0 110.753 179.08 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.526 ' HB ' ' O ' ' C' ' 109' ' ' TYR . 10.9 t -95.97 -41.38 11.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.954 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.598 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 15.7 tt0 -102.52 101.69 11.89 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-O 122.459 1.124 . . . . 0.0 111.221 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.633 ' H ' ' HD3' ' C' ' 116' ' ' PRO . 0.2 OUTLIER -167.68 -37.98 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 112.651 -2.068 . . . . 0.0 109.723 -179.531 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.473 ' N ' ' CD ' ' C' ' 116' ' ' PRO . 0.1 OUTLIER -120.93 23.57 0.11 Allowed Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.633 ' HD3' ' H ' ' C' ' 114' ' ' LEU . 66.3 Cg_endo -88.95 -168.82 0.36 Allowed 'Trans proline' 0 C--N 1.362 1.262 0 CA-C-N 121.782 1.672 . . . . 0.0 113.026 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -89.52 28.2 1.33 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.324 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -78.67 135.53 15.9 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.657 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -102.3 131.6 10.66 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.494 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.446 HD13 HG21 ' C' ' 120' ' ' ILE . 10.1 tt . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.706 179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.449 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.96 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.592 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 2.3 mm? -119.8 -61.59 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.756 0.278 . . . . 0.0 111.023 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.592 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 6.2 Cg_endo -53.27 -49.63 16.8 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.13 2.553 . . . . 0.0 113.31 -177.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -61.75 -33.97 75.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.661 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 1' ' ' GLY . 90.1 t -69.42 -50.65 49.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.69 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.597 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.0 -24.84 64.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.289 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.669 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 70.7 m -69.66 -26.18 64.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.0 tp -73.59 -23.55 59.95 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.053 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.597 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 48.4 mmm-85 -63.45 -23.68 67.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.253 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.669 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.4 mt-30 -76.34 -43.21 42.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.522 -179.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.506 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 52.0 tt0 -70.03 -29.29 66.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.454 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.9 t -74.6 -36.37 40.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.077 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 88.7 tt0 -66.36 -32.12 73.31 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 177.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.506 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.98 -56.73 11.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.283 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.635 ' O ' HG22 ' A' ' 19' ' ' VAL . 4.6 mp -57.7 -39.08 76.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.034 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 20.1 pt20 -70.67 -31.33 68.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.1 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -72.72 -31.14 62.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 119.933 -1.127 . . . . 0.0 111.494 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 14' ' ' ALA . 77.6 mm-40 -76.37 -35.52 58.63 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 120.806 0.336 . . . . 0.0 110.575 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.635 HG22 ' O ' ' A' ' 15' ' ' LEU . 58.7 t -77.16 -32.03 18.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.729 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -67.98 -40.12 83.17 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.487 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.486 ' HD1' ' HA ' ' A' ' 18' ' ' GLN . 6.8 p-80 -80.44 -25.6 38.86 Favored 'General case' 0 N--CA 1.46 0.049 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.928 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.675 ' HG ' ' HD2' ' B' ' 66' ' ' PHE . 0.1 OUTLIER -72.87 -39.73 66.22 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.863 178.475 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.668 ' HG3' HD22 ' C' ' 102' ' ' LEU . 26.6 tt0 -70.71 -36.86 73.44 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.87 -56.61 19.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.967 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.35 -48.21 82.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.77 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.495 ' HE2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.54 -24.84 22.53 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.064 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.2 t -49.61 -32.2 12.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.64 0.257 . . . . 0.0 111.04 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.436 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 12.9 mm100 -96.3 -45.63 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.081 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.546 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.8 m-85 -66.47 -20.08 65.95 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -73.24 -4.4 32.82 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.908 0.385 . . . . 0.0 110.868 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.76 36.06 4.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.983 0.897 . . . . 0.0 108.73 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.546 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 12.8 t -100.58 -34.63 4.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.127 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -85.62 81.64 8.57 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 122.969 1.366 . . . . 0.0 111.417 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.456 HD13 ' N ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -163.69 -37.3 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 111.95 -2.387 . . . . 0.0 109.539 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.456 ' N ' HD13 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -120.22 38.85 0.33 Allowed Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 179.045 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 73.4 Cg_endo -75.33 179.63 5.98 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.464 1.443 . . . . 0.0 111.747 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -94.07 65.11 3.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.322 0.582 . . . . 0.0 109.697 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 129.29 -168.34 20.95 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.768 -0.729 . . . . 0.0 111.937 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -147.0 -70.06 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.146 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.155 179.51 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.502 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.971 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.585 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 2.3 mm? -117.82 -62.07 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 117.073 0.437 . . . . 0.0 111.342 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.585 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 5.2 Cg_endo -52.06 -49.07 18.56 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 123.337 2.692 . . . . 0.0 113.679 -177.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.21 -31.61 72.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.566 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.502 HG23 ' O ' ' B' ' 41' ' ' GLY . 97.7 t -71.3 -50.87 38.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.564 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.612 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -68.84 -25.58 64.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.244 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.692 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 73.4 m -69.01 -26.22 64.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 55.7 tp -73.1 -23.79 60.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.066 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.612 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 47.8 mmm-85 -63.81 -21.85 66.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.973 0.415 . . . . 0.0 110.215 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.8 mt-30 -77.94 -43.68 29.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.287 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 52.0 tt0 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.622 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 26.7 t -74.85 -37.79 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.37 -31.79 73.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.513 ' O ' ' HG2' ' B' ' 58' ' ' GLN . . . -65.35 -56.58 11.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.442 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.623 ' O ' HG22 ' B' ' 59' ' ' VAL . 4.7 mp -57.68 -39.23 76.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.93 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -70.35 -31.95 69.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.087 -179.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.571 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -71.98 -30.89 64.98 Favored Glycine 0 C--O 1.238 0.396 0 C-N-CA 120.08 -1.057 . . . . 0.0 111.373 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' B' ' 54' ' ' ALA . 77.0 mm-40 -76.58 -36.49 57.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.795 0.331 . . . . 0.0 110.528 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.623 HG22 ' O ' ' B' ' 55' ' ' LEU . 59.9 t -76.28 -31.29 20.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 122.256 -0.278 . . . . 0.0 110.711 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.571 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -69.02 -40.51 78.62 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.279 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.5 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 6.8 p-80 -80.18 -24.97 39.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 119.856 -0.738 . . . . 0.0 111.061 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.63 ' HG ' ' HD2' ' C' ' 106' ' ' PHE . 0.1 OUTLIER -74.03 -39.5 63.53 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.584 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.463 ' HG3' ' CD1' ' A' ' 22' ' ' LEU . 23.3 tt0 -69.93 -38.72 76.29 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.57 30.6 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.122 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.51 -48.03 82.9 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.797 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.675 ' HD2' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.65 -24.39 21.45 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.286 -179.615 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -49.96 -31.88 13.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.772 0.32 . . . . 0.0 110.999 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.415 ' O ' ' HG3' ' B' ' 71' ' ' LYS . 12.8 mm100 -96.83 -44.86 6.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 111.096 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.531 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.4 m-85 -67.12 -19.69 65.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -73.57 -4.07 31.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.023 0.439 . . . . 0.0 110.786 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -127.98 35.89 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.782 0.801 . . . . 0.0 109.012 177.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.531 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 11.8 t -100.33 -34.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.101 -179.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -84.79 80.89 9.11 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 123.11 1.434 . . . . 0.0 111.402 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.414 HD13 ' N ' ' B' ' 75' ' ' PHE . 0.3 OUTLIER -163.61 -34.5 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 111.978 -2.374 . . . . 0.0 109.926 179.584 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.423 ' N ' ' CD ' ' B' ' 76' ' ' PRO . 0.0 OUTLIER -123.15 38.59 0.38 Allowed Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 178.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 71.8 Cg_endo -75.7 177.5 8.61 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.507 1.471 . . . . 0.0 111.738 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -91.78 67.93 5.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.332 0.587 . . . . 0.0 109.731 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 128.63 -164.36 21.83 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.166 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -151.83 -71.6 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.948 -0.644 . . . . 0.0 111.848 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.184 -0.912 . . . . 0.0 109.684 179.509 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.66 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.59 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 5.5 mt -125.45 -61.71 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.59 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 8.4 Cg_endo -53.09 -46.86 30.88 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.899 2.4 . . . . 0.0 112.808 -179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -63.95 -33.73 76.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.329 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 92.1 t -69.19 -50.99 47.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.7 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.626 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.68 -25.02 64.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.283 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.683 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 73.4 m -69.67 -25.75 64.05 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 54.9 tp -73.77 -23.6 59.74 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.984 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.626 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 48.3 mmm-85 -64.21 -21.7 66.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.194 178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.683 ' HG3' ' O ' ' C' ' 87' ' ' SER . 3.8 mt-30 -78.45 -43.47 27.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.027 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 51.8 tt0 -69.42 -29.91 67.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.728 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 25.3 t -74.71 -36.14 39.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.819 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.402 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 87.5 tt0 -66.03 -31.27 72.06 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -66.02 -56.42 11.69 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.249 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.633 ' O ' HG22 ' C' ' 99' ' ' VAL . 7.3 mt -57.05 -40.33 76.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.703 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.402 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 20.0 pt20 -70.06 -32.32 70.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.397 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.581 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -71.62 -31.66 65.09 Favored Glycine 0 C--O 1.239 0.451 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.268 178.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' C' ' 94' ' ' ALA . 77.0 mm-40 -76.2 -34.91 59.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.674 0.273 . . . . 0.0 110.706 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.633 HG22 ' O ' ' C' ' 95' ' ' LEU . 60.1 t -77.52 -31.46 17.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.697 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -68.71 -38.72 80.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.324 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.577 ' CE1' HD23 ' C' ' 102' ' ' LEU . 6.3 p-80 -81.77 -26.41 34.47 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.604 -0.839 . . . . 0.0 111.097 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.668 HD22 ' HG3' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -67.54 -47.09 70.88 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.712 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.406 ' HG3' ' CD1' ' B' ' 62' ' ' LEU . 24.2 tt0 -67.51 -38.38 84.21 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.31 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.43 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -55.64 -55.96 25.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.002 178.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.01 -47.78 84.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.993 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.63 ' HD2' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -54.93 -24.01 21.66 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.968 -179.432 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.2 t -50.44 -31.04 14.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.638 0.256 . . . . 0.0 110.841 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' C' ' 111' ' ' LYS . 12.8 mm100 -97.58 -46.0 6.19 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.002 178.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.574 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 15.5 m-85 -65.98 -19.98 66.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -72.75 -5.15 35.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.024 0.44 . . . . 0.0 110.856 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -126.8 35.39 4.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.97 0.891 . . . . 0.0 108.908 177.636 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.574 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -99.4 -34.81 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.236 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -85.19 81.43 8.83 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 123.081 1.42 . . . . 0.0 111.427 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -163.57 -36.87 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 112.029 -2.35 . . . . 0.0 109.62 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.401 ' N ' ' CD ' ' C' ' 116' ' ' PRO . 0.0 OUTLIER -120.76 39.3 0.36 Allowed Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 72.3 Cg_endo -76.28 178.16 7.86 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.623 1.548 . . . . 0.0 111.7 179.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -92.78 67.4 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.557 0.694 . . . . 0.0 109.967 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 128.59 -164.89 21.65 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.188 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.32 -72.59 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.715 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.981 179.389 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.723 -0.551 . . . . 0.0 111.723 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.597 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 93.4 mt -115.78 -56.38 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.665 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.597 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 51.6 Cg_exo -45.48 -46.22 14.77 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 122.812 2.342 . . . . 0.0 113.496 -178.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.61 -29.34 70.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.697 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t -67.78 -47.69 78.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.654 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.8 -27.0 62.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.393 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 66.2 m -71.0 -17.49 62.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.813 0.816 . . . . 0.0 109.247 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.6 tp -78.21 -21.83 49.46 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.485 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.654 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -69.62 -16.65 63.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.46 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.417 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 9.0 mm-40 -77.87 -40.02 41.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.774 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.526 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 3.7 tp-100 -73.24 -25.18 60.62 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.014 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.87 -45.92 54.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.8 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -67.53 -26.91 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB1' ' O ' ' A' ' 11' ' ' GLN . . . -63.07 -54.29 40.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.36 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.551 HD11 ' HA ' ' B' ' 56' ' ' GLN . 13.1 tp -60.86 -32.96 72.37 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.647 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.613 ' O ' HG11 ' A' ' 19' ' ' VAL . 10.3 tt0 -63.6 -36.42 83.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.33 178.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.21 -31.43 76.94 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.803 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.62 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 71.0 mt-30 -73.98 -47.54 36.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.093 0.473 . . . . 0.0 111.213 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.613 HG11 ' O ' ' A' ' 16' ' ' GLN . 7.6 p -66.48 -36.16 76.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -65.78 -44.58 85.35 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.869 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.531 ' O ' ' HB1' ' A' ' 24' ' ' ALA . 7.7 p-80 -75.36 -13.76 60.43 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.368 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.62 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -73.58 -34.69 65.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.29 -35.41 77.8 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.531 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -57.41 -50.69 72.18 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.531 178.056 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.494 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.79 -42.46 99.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.056 178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.531 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 6.6 m-85 -56.27 -27.28 54.71 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.71 179.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t -54.63 -27.13 37.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.164 0.507 . . . . 0.0 110.606 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.644 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 87.4 mm-40 -94.68 -37.6 11.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.607 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.564 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 37.7 m-85 -77.98 -18.81 55.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 0.0 111.481 -179.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.531 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 4.2 tmtt? -58.04 -49.88 75.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.42 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.647 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER -88.77 39.46 0.92 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.206 1.003 . . . . 0.0 110.501 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.683 HG21 ' HA ' ' B' ' 73' ' ' GLU . 51.4 t -125.1 -10.55 5.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.673 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.766 ' HG3' HD12 ' A' ' 34' ' ' LEU . 10.8 pt-20 -75.45 -35.19 60.95 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.766 HD12 ' HG3' ' A' ' 33' ' ' GLU . 0.2 OUTLIER -64.22 -76.73 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.862 0.839 . . . . 0.0 112.732 -177.488 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.407 ' H ' ' HB2' ' A' ' 34' ' ' LEU . 42.3 m-85 -32.54 -50.02 0.57 Allowed Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 117.656 2.465 . . . . 0.0 117.656 -176.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -75.69 17.12 0.7 Allowed 'Trans proline' 0 N--CA 1.473 0.29 0 C-N-CA 121.818 1.679 . . . . 0.0 114.548 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -101.31 103.67 14.65 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -31.03 78.97 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 121.121 -0.562 . . . . 0.0 113.608 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.09 34.08 9.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.945 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.174 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.024 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.565 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 95.6 mt -114.91 -57.04 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.411 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.834 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.565 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 50.7 Cg_exo -44.8 -46.01 13.09 Favored 'Trans proline' 0 C--N 1.363 1.337 0 C-N-CA 123.099 2.533 . . . . 0.0 113.31 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -63.44 -29.42 70.71 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.638 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 41.8 t -68.69 -47.49 76.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.652 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.27 -25.84 61.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.34 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 68.2 m -71.74 -17.56 62.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.933 0.873 . . . . 0.0 109.429 178.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 61.4 tp -78.02 -22.68 48.87 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.269 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 0.3 OUTLIER -68.85 -15.57 63.53 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.444 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.451 ' H ' ' HG2' ' B' ' 50' ' ' GLN . 8.5 mm-40 -79.57 -39.34 31.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.767 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.523 ' O ' ' HB1' ' B' ' 54' ' ' ALA . 3.8 tp-100 -74.16 -25.04 59.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.833 0.825 . . . . 0.0 109.037 178.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.89 -45.66 54.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.7 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -68.04 -26.58 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.523 ' HB1' ' O ' ' B' ' 51' ' ' GLN . . . -63.89 -52.97 57.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.604 HD11 ' HA ' ' C' ' 96' ' ' GLN . 13.3 tp -62.11 -32.36 72.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.632 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.602 ' O ' HG11 ' B' ' 59' ' ' VAL . 9.0 tt0 -64.31 -35.73 81.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.219 178.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.415 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.71 -31.28 77.45 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.84 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.606 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.3 mt-30 -73.88 -47.77 35.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.035 0.445 . . . . 0.0 110.982 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.602 HG11 ' O ' ' B' ' 56' ' ' GLN . 7.5 p -66.27 -36.23 76.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.6 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 17.4 pt20 -65.64 -44.47 86.3 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.664 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.547 ' O ' ' HB1' ' B' ' 64' ' ' ALA . 7.5 p-80 -75.59 -13.46 60.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.651 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.3 mt -74.22 -35.09 63.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -67.79 -35.6 78.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.547 ' HB1' ' O ' ' B' ' 61' ' ' HIS . . . -57.06 -51.4 69.42 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.508 -1.223 . . . . 0.0 109.378 177.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.507 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.63 -43.41 97.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.884 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.539 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 7.4 m-85 -55.53 -28.24 53.6 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.679 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.7 t -53.66 -27.41 27.32 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.249 0.547 . . . . 0.0 110.775 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.666 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 89.6 mm-40 -94.64 -38.65 10.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.496 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.544 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 36.0 m-85 -77.04 -18.58 58.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.919 0.39 . . . . 0.0 111.675 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 4.5 tmtt? -58.77 -49.08 78.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.363 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.666 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.2 OUTLIER -89.25 39.65 0.95 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.989 0.899 . . . . 0.0 110.363 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.7 HG21 ' HA ' ' C' ' 113' ' ' GLU . 55.6 t -125.66 -9.87 5.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.734 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.777 ' HG3' HD12 ' B' ' 74' ' ' LEU . 12.1 pt-20 -76.27 -34.24 59.12 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.777 HD12 ' HG3' ' B' ' 73' ' ' GLU . 0.2 OUTLIER -65.42 -75.96 0.08 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.909 0.862 . . . . 0.0 112.972 -177.526 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -33.01 -50.14 0.63 Allowed Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 -176.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.415 ' HG3' HG11 ' A' ' 32' ' ' VAL . 67.8 Cg_endo -76.14 19.21 0.61 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.214 1.943 . . . . 0.0 114.359 -177.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -103.95 104.5 14.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.24 -36.33 92.86 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.209 -178.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 94.72 31.24 7.91 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.546 -0.835 . . . . 0.0 111.582 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.292 -0.861 . . . . 0.0 109.79 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.921 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.586 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 93.1 mt -116.49 -56.24 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.633 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.586 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 52.3 Cg_exo -45.49 -46.5 14.44 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.831 2.354 . . . . 0.0 113.153 -179.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -63.1 -29.44 70.81 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 40.2 t -68.02 -47.85 77.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.668 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.15 -26.27 62.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.464 . . . . 0.0 110.414 178.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 70.6 m -70.7 -17.65 62.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.917 0.865 . . . . 0.0 109.415 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.674 ' O ' HG12 ' C' ' 92' ' ' VAL . 53.1 tp -79.23 -22.99 44.03 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.654 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -69.79 -12.56 61.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.459 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.44 27.57 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.455 ' O ' ' HB1' ' C' ' 94' ' ' ALA . 3.3 tp-100 -75.01 -27.11 59.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.906 177.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.674 HG12 ' O ' ' C' ' 88' ' ' LEU . 1.5 m -75.76 -38.08 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.561 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.503 ' N ' HG21 ' C' ' 92' ' ' VAL . 35.8 tt0 -68.38 -27.87 66.62 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.455 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -63.99 -52.41 59.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.15 178.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' A' ' 16' ' ' GLN . 13.1 tp -61.47 -33.46 73.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.738 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.611 ' O ' HG11 ' C' ' 99' ' ' VAL . 10.6 tt0 -63.54 -35.72 81.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.391 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.421 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.5 -31.64 78.31 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.755 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.611 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 64.0 mt-30 -74.05 -47.37 37.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.097 0.475 . . . . 0.0 111.137 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.611 HG11 ' O ' ' C' ' 96' ' ' GLN . 7.6 p -66.53 -35.58 75.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.811 -179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 16.4 pt20 -66.35 -44.29 83.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.951 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.554 ' O ' ' HB1' ' C' ' 104' ' ' ALA . 8.7 p-80 -75.88 -13.46 60.27 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.611 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 6.2 mt -72.93 -35.84 67.11 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -67.3 -36.03 80.68 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 176.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.554 ' HB1' ' O ' ' C' ' 101' ' ' HIS . . . -56.46 -51.38 68.64 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.621 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.518 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.23 -42.81 99.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.291 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.561 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 15.6 m-85 -56.05 -27.88 55.21 Favored 'General case' 0 C--O 1.214 -0.816 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.563 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 24.1 t -52.99 -26.45 15.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.151 0.5 . . . . 0.0 110.694 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.711 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 91.2 mm-40 -96.49 -37.75 10.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.57 ' O ' ' HB ' ' C' ' 112' ' ' VAL . 37.0 m-85 -78.32 -18.95 54.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.997 0.427 . . . . 0.0 111.494 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' C' ' 106' ' ' PHE . 3.7 tmtt? -58.79 -47.39 84.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.598 -179.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.2 OUTLIER -90.47 38.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.095 0.95 . . . . 0.0 110.138 178.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.75 HG21 ' HA ' ' A' ' 33' ' ' GLU . 53.6 t -124.48 -10.37 6.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.813 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.754 ' HG3' HD12 ' C' ' 114' ' ' LEU . 10.4 pt-20 -75.37 -36.4 60.95 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.754 HD12 ' HG3' ' C' ' 113' ' ' GLU . 0.2 OUTLIER -63.18 -76.3 0.07 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.979 0.895 . . . . 0.0 113.023 -177.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -32.67 -50.95 0.61 Allowed Pre-proline 0 N--CA 1.477 0.889 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -176.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -74.74 18.34 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.156 1.904 . . . . 0.0 114.708 -177.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -103.59 103.66 13.62 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.6 -33.76 87.53 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 116.118 -0.492 . . . . 0.0 113.347 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 92.2 31.9 8.73 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.141 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.468 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.43 ' O ' HG22 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.879 -0.488 . . . . 0.0 111.879 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.474 ' HA ' HD13 ' A' ' 2' ' ' LEU . 0.9 OUTLIER -58.46 -54.51 55.28 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.967 0.383 . . . . 0.0 111.208 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.463 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 54.0 Cg_exo -45.44 -40.91 17.95 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 122.804 2.336 . . . . 0.0 113.01 -179.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -69.58 -22.43 63.53 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.9 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.43 HG22 ' O ' ' A' ' 1' ' ' GLY . 90.2 t -68.38 -48.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.958 0.409 . . . . 0.0 110.196 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.946 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.99 -25.77 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.832 179.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.685 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 67.7 m -71.69 -22.31 61.67 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.519 HD23 HD23 ' B' ' 48' ' ' LEU . 62.1 tp -78.92 -26.3 43.69 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.799 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.946 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -64.23 -49.0 73.68 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.491 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.4 pt20 -61.99 -48.5 80.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.108 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.485 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 15.8 pt20 -68.41 -21.24 64.69 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.198 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.36 -34.92 21.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.716 ' HA ' HE21 ' A' ' 16' ' ' GLN . 48.9 mt-10 -70.1 -28.03 65.08 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -64.91 -58.57 5.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.177 178.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.5 HD21 HG12 ' B' ' 59' ' ' VAL . 1.2 tm? -62.01 -36.28 81.07 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.703 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.716 HE21 ' HA ' ' A' ' 13' ' ' GLU . 9.4 pt20 -71.06 -22.3 62.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.675 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -69.05 -32.8 73.35 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.056 -1.068 . . . . 0.0 110.655 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.753 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 54.1 mt-30 -72.65 -49.85 29.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.47 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.552 ' HB ' HG23 ' B' ' 59' ' ' VAL . 2.9 p -67.42 -28.71 43.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.833 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 13.2 pt20 -67.38 -43.93 80.2 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.407 ' HA ' ' HB1' ' A' ' 24' ' ' ALA . 7.2 p-80 -77.73 -18.34 56.64 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.139 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.753 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 44.9 mt -72.24 -40.27 67.85 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.502 HE21 ' HB3' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -70.79 -36.85 73.22 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.407 ' HB1' ' HA ' ' A' ' 21' ' ' HIS . . . -57.03 -54.87 41.8 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.098 178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB3' ' HE2' ' A' ' 29' ' ' TYR . . . -61.58 -44.39 97.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.402 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.483 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -54.93 -26.53 36.75 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.422 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -50.15 -24.79 2.98 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.88 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.684 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 99.0 mm-40 -102.27 -41.09 6.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.375 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.689 ' HA ' HG22 ' A' ' 32' ' ' VAL . 38.5 m-85 -73.28 -19.59 61.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -178.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 26' ' ' PHE . 43.1 mtmt -69.95 -8.86 52.33 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.855 0.359 . . . . 0.0 110.726 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.684 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.81 37.05 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.74 0.781 . . . . 0.0 109.78 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.689 HG22 ' HA ' ' A' ' 29' ' ' TYR . 8.2 t -100.95 -43.27 10.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.134 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.48 ' HB2' HG11 ' C' ' 112' ' ' VAL . 31.9 tt0 -87.4 88.92 7.81 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 122.613 1.196 . . . . 0.0 111.259 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.467 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER -163.1 -39.96 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.552 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.804 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 83.7 m-85 -55.45 -59.87 9.97 Favored Pre-proline 0 N--CA 1.471 0.599 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.881 178.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.804 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 71.4 Cg_endo -85.69 -178.04 2.82 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.42 2.08 . . . . 0.0 111.834 178.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -93.67 94.16 8.43 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.79 -15.1 78.5 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.38 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.74 80.86 1.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.551 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.9 mm . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.253 -0.879 . . . . 0.0 109.796 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.414 ' O ' HG22 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.861 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.437 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 0.9 OUTLIER -57.81 -54.75 52.1 Favored Pre-proline 0 N--CA 1.469 0.52 0 CA-C-N 117.174 0.487 . . . . 0.0 111.239 179.367 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.437 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 50.1 Cg_exo -45.84 -39.56 19.07 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.568 2.179 . . . . 0.0 112.961 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -70.57 -23.43 62.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.506 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.417 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 96.6 t -67.24 -49.38 72.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.35 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.979 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.36 -25.6 61.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.869 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.672 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 66.4 m -71.86 -21.92 61.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.519 HD23 HD23 ' A' ' 8' ' ' LEU . 62.3 tp -79.29 -26.46 42.3 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.434 177.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.979 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -63.34 -49.46 73.84 Favored 'General case' 0 N--CA 1.461 0.106 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.25 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.5 pt20 -62.21 -48.25 80.82 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.295 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.484 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 15.9 pt20 -68.21 -21.64 64.84 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 120.145 -0.622 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -34.79 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.749 ' HA ' HE21 ' B' ' 56' ' ' GLN . 48.4 mt-10 -69.54 -30.13 67.88 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -62.99 -59.12 5.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.521 178.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -61.6 -35.47 77.96 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.749 HE21 ' HA ' ' B' ' 53' ' ' GLU . 9.2 pt20 -71.57 -22.21 61.77 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.769 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.688 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -68.9 -33.97 76.14 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.762 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 55.5 mt-30 -71.48 -48.95 45.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.069 0.461 . . . . 0.0 110.575 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.552 HG23 ' HB ' ' A' ' 19' ' ' VAL . 2.9 p -68.77 -28.05 38.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.814 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.688 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 13.3 pt20 -67.7 -43.26 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.439 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.415 ' HA ' ' HB1' ' B' ' 64' ' ' ALA . 7.3 p-80 -78.31 -19.11 54.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.991 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.762 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 50.7 mt -71.55 -40.73 69.84 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.438 HE21 ' HB3' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -70.29 -37.34 74.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.415 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -56.45 -55.33 35.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.149 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.444 ' HB3' ' HE2' ' B' ' 69' ' ' TYR . . . -61.18 -44.75 96.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.377 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.519 ' HD1' ' HB2' ' B' ' 69' ' ' TYR . 0.0 OUTLIER -54.84 -26.5 35.63 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.336 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -48.9 -27.49 3.13 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.984 0.421 . . . . 0.0 110.595 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.725 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 96.7 mm-40 -99.92 -41.14 7.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.725 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.692 ' HA ' HG22 ' B' ' 72' ' ' VAL . 38.6 m-85 -72.85 -19.83 61.23 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 66' ' ' PHE . 41.5 mtmt -69.5 -8.34 46.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.67 0.271 . . . . 0.0 110.745 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.725 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -129.44 38.12 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.133 0.968 . . . . 0.0 109.782 178.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.692 HG22 ' HA ' ' B' ' 69' ' ' TYR . 10.4 t -101.61 -43.57 10.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.809 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.517 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 31.4 tt0 -87.68 89.38 7.97 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 122.742 1.258 . . . . 0.0 111.314 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.487 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.1 OUTLIER -164.36 -38.73 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.313 -2.221 . . . . 0.0 109.4 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.805 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 84.5 m-85 -56.72 -59.92 10.91 Favored Pre-proline 0 CA--C 1.537 0.463 0 O-C-N 123.469 0.481 . . . . 0.0 110.029 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.805 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 98.0 Cg_endo -86.2 -178.34 2.77 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.613 2.209 . . . . 0.0 112.074 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -93.6 91.58 7.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.71 -16.53 79.03 Favored Glycine 0 CA--C 1.518 0.239 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.097 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.75 79.81 1.64 Allowed Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.362 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.3 mm . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.437 -179.77 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.415 ' O ' HG22 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.442 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 13.1 mt -62.47 -53.73 54.99 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.355 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.442 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 50.6 Cg_exo -45.75 -38.1 17.02 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.556 2.171 . . . . 0.0 112.52 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -72.03 -23.12 61.33 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.898 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.427 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 84.7 t -66.65 -48.65 79.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.939 0.4 . . . . 0.0 109.994 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 1.016 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.62 -25.24 61.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.845 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.666 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 64.2 m -72.48 -21.21 61.25 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.488 HD23 HD23 ' A' ' 8' ' ' LEU . 63.4 tp -79.9 -26.3 40.27 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.626 177.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 1.016 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.7 OUTLIER -64.23 -48.14 76.95 Favored 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.666 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.5 pt20 -63.5 -47.7 80.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.931 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' C' ' 88' ' ' LEU . 16.1 pt20 -69.21 -20.51 63.98 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 119.999 -0.68 . . . . 0.0 111.0 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.05 -34.68 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.688 ' HA ' HE21 ' C' ' 96' ' ' GLN . 47.4 mt-10 -69.86 -30.32 67.76 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.476 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -61.58 -59.8 4.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.088 -1.415 . . . . 0.0 110.092 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.69 -38.81 89.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.455 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.688 HE21 ' HA ' ' C' ' 93' ' ' GLU . 10.0 pt20 -66.64 -22.1 66.11 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.564 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.659 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -68.6 -32.95 75.38 Favored Glycine 0 C--O 1.24 0.473 0 C-N-CA 120.084 -1.055 . . . . 0.0 110.753 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.78 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 52.7 mt-30 -72.04 -46.97 54.99 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.665 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.77 -37.55 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.125 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.659 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 14.6 pt20 -62.34 -42.14 99.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -177.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.474 ' HA ' ' HB1' ' C' ' 104' ' ' ALA . 6.4 p-80 -80.48 -17.83 50.45 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.44 179.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.78 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 48.4 mt -73.53 -40.49 63.96 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.464 HE21 ' HB3' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -71.1 -37.57 72.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.661 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.474 ' HB1' ' HA ' ' C' ' 101' ' ' HIS . . . -56.69 -55.88 28.53 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.043 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.458 ' HB3' ' HE2' ' C' ' 109' ' ' TYR . . . -61.85 -44.08 97.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.46 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.471 ' HD1' ' HB2' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -55.0 -25.23 28.53 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.596 -179.82 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 32.0 t -51.33 -26.23 7.25 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.09 0.471 . . . . 0.0 110.887 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.688 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 99.2 mm-40 -100.72 -40.76 7.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.321 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.69 ' HA ' HG12 ' C' ' 112' ' ' VAL . 39.5 m-85 -73.1 -19.21 61.2 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' C' ' 106' ' ' PHE . 43.9 mtmt -69.53 -8.88 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.652 0.263 . . . . 0.0 110.435 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.688 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -127.85 34.41 4.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.599 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.69 HG12 ' HA ' ' C' ' 109' ' ' TYR . 0.8 OUTLIER -103.44 -35.03 3.6 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.399 177.759 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.508 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 31.3 tt0 -85.85 87.24 7.38 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.849 1.309 . . . . 0.0 110.454 178.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.458 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER -164.82 -38.81 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 112.14 -2.3 . . . . 0.0 109.313 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.801 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 83.5 m-85 -56.42 -59.63 11.52 Favored Pre-proline 0 N--CA 1.468 0.458 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.801 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 67.9 Cg_endo -86.51 -179.35 3.02 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.49 2.127 . . . . 0.0 112.042 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -92.39 92.93 8.34 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.63 -16.74 77.03 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.98 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.39 82.25 1.39 Allowed Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.706 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 39.6 mm . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.336 -179.7 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.486 ' O ' HG22 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.526 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 91.1 mt -56.92 -55.91 38.78 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 6.1 Cg_exo -46.31 -44.69 19.88 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.258 2.638 . . . . 0.0 113.1 -178.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -66.3 -41.46 89.72 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.094 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 1' ' ' GLY . 91.1 t -64.36 -41.92 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.613 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.58 -29.52 68.9 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.681 179.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.663 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.0 m -67.03 -23.41 65.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.394 0.616 . . . . 0.0 109.736 178.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.551 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 68.0 tp -79.39 -24.66 42.45 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.449 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.613 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 12.7 mmm-85 -71.83 -33.69 68.7 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.663 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -75.19 -42.61 55.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.379 179.093 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.468 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 97.3 mm-40 -65.2 -32.8 74.66 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.401 0.619 . . . . 0.0 110.308 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -77.91 -26.94 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.172 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -69.55 -30.62 68.47 Favored 'General case' 0 C--O 1.227 -0.091 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.468 ' HB1' ' O ' ' A' ' 11' ' ' GLN . . . -68.14 -51.41 46.39 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.69 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD13 ' HB2' ' B' ' 56' ' ' GLN . 52.1 mt -58.7 -31.92 68.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.073 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.552 ' O ' HG11 ' A' ' 19' ' ' VAL . 21.1 tt0 -70.6 -48.26 56.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.711 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.453 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -59.61 -29.69 67.36 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.602 -0.809 . . . . 0.0 111.435 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.711 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.35 -50.51 21.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.045 0.45 . . . . 0.0 111.065 179.579 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG11 ' O ' ' A' ' 16' ' ' GLN . 14.5 p -67.62 -31.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.5 pt20 -70.45 -41.53 72.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.811 -0.177 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.408 ' O ' ' HB1' ' A' ' 24' ' ' ALA . 6.4 p-80 -78.07 -18.31 55.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.239 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.711 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 15.3 mt -71.19 -40.29 71.31 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.001 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.14 -34.01 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' A' ' 21' ' ' HIS . . . -56.93 -55.68 31.44 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.296 178.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.434 ' HB2' ' HE2' ' A' ' 29' ' ' TYR . . . -62.96 -39.08 93.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.479 178.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.492 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -55.73 -26.49 45.71 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.516 179.459 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.9 t -50.2 -32.54 16.69 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.225 0.536 . . . . 0.0 110.371 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.755 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 16.2 mm100 -87.88 -53.69 4.62 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.342 177.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.772 ' HA ' HG23 ' A' ' 32' ' ' VAL . 14.1 m-85 -60.7 -20.59 61.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 14.7 mttp -66.11 -35.35 80.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.497 0.189 . . . . 0.0 110.822 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.755 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -100.35 33.17 2.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.232 0.539 . . . . 0.0 110.825 179.591 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.772 HG23 ' HA ' ' A' ' 29' ' ' TYR . 67.5 t -97.24 -43.97 12.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.708 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.618 ' HB2' HG22 ' C' ' 112' ' ' VAL . 7.0 tt0 -119.74 105.48 11.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.315 1.055 . . . . 0.0 109.583 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.746 HD22 ' CD2' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -167.97 -33.93 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.007 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.775 ' CD1' ' HD3' ' A' ' 36' ' ' PRO . 7.2 p90 -79.9 -37.85 1.14 Allowed Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.678 177.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.775 ' HD3' ' CD1' ' A' ' 35' ' ' PHE . 22.7 Cg_endo -95.87 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 122.376 2.051 . . . . 0.0 111.181 178.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -150.57 81.79 1.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.37 -128.46 27.63 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.244 -178.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -166.99 -90.09 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.697 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.544 HD12 HG22 ' A' ' 40' ' ' ILE . 4.8 tt . . . . . 0 C--O 1.245 0.836 0 CA-C-O 118.558 -0.734 . . . . 0.0 109.651 178.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.5 ' O ' HG22 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 112.196 -0.362 . . . . 0.0 112.196 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.536 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 89.1 mt -57.62 -55.53 43.77 Favored Pre-proline 0 N--CA 1.464 0.264 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.536 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 6.0 Cg_exo -46.77 -45.42 20.3 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.081 2.52 . . . . 0.0 113.07 -178.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.51 -40.44 93.0 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.5 HG22 ' O ' ' B' ' 41' ' ' GLY . 85.6 t -65.21 -42.15 93.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.631 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.87 -29.15 68.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.811 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 53.7 m -67.29 -23.33 65.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.42 0.628 . . . . 0.0 109.847 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.547 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 66.8 tp -79.57 -24.6 41.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.295 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.631 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 13.2 mmm-85 -71.62 -33.44 68.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -75.8 -41.81 51.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.425 179.221 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' B' ' 47' ' ' SER . 97.2 mm-40 -65.57 -33.42 75.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.563 0.697 . . . . 0.0 110.083 178.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.547 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 0.3 OUTLIER -76.99 -27.07 16.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.261 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -69.58 -31.35 69.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.458 ' HB1' ' O ' ' B' ' 51' ' ' GLN . . . -67.6 -50.72 56.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.077 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 52.6 mt -59.04 -32.47 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.967 179.482 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.546 ' O ' HG11 ' B' ' 59' ' ' VAL . 22.6 tt0 -70.26 -48.0 58.78 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.715 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.435 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.97 -29.13 67.29 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.515 -0.85 . . . . 0.0 111.653 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.737 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -74.03 -50.05 21.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.936 0.398 . . . . 0.0 110.96 179.453 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.546 HG11 ' O ' ' B' ' 56' ' ' GLN . 14.8 p -67.84 -31.8 53.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 122.131 -0.356 . . . . 0.0 111.902 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.6 pt20 -70.23 -41.74 73.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.779 -0.192 . . . . 0.0 110.836 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.408 ' HA ' ' HB1' ' B' ' 64' ' ' ALA . 6.5 p-80 -78.17 -18.38 55.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.762 -0.775 . . . . 0.0 110.463 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.737 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 16.5 mt -71.41 -39.16 71.29 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -71.85 -33.72 68.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.408 ' HB1' ' HA ' ' B' ' 61' ' ' HIS . . . -57.51 -55.19 38.03 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.3 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.407 ' HB2' ' HE2' ' B' ' 69' ' ' TYR . . . -63.41 -39.21 93.88 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.354 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.505 ' HD1' ' HB2' ' B' ' 69' ' ' TYR . 0.0 OUTLIER -55.95 -26.13 46.6 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.457 179.329 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -50.74 -31.78 17.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.201 0.524 . . . . 0.0 110.226 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.732 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 15.9 mm100 -88.09 -53.51 4.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.413 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.804 ' HA ' HG23 ' B' ' 72' ' ' VAL . 13.2 m-85 -60.97 -20.95 63.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 14.7 mttp -65.66 -36.08 82.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.877 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.732 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -99.6 33.11 2.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.481 0.658 . . . . 0.0 110.989 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.804 HG23 ' HA ' ' B' ' 69' ' ' TYR . 62.5 t -96.82 -43.55 12.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.789 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.56 ' HB2' HG22 ' A' ' 32' ' ' VAL . 5.8 tt0 -120.29 105.61 11.09 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.301 1.048 . . . . 0.0 109.733 176.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.77 HD22 ' CD2' ' B' ' 75' ' ' PHE . 0.2 OUTLIER -168.65 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 112.771 -2.013 . . . . 0.0 108.686 -178.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.781 ' CD1' ' HD3' ' B' ' 76' ' ' PRO . 6.5 p90 -78.87 -38.95 1.45 Allowed Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.508 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.781 ' HD3' ' CD1' ' B' ' 75' ' ' PHE . 23.7 Cg_endo -96.22 -159.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 122.594 2.196 . . . . 0.0 111.191 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -145.98 83.65 1.64 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.49 -131.27 32.13 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.261 -178.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -163.92 -89.34 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.884 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.501 HD12 HG22 ' B' ' 80' ' ' ILE . 5.6 tt . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.13 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.464 ' O ' HG22 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 112.246 -0.341 . . . . 0.0 112.246 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.527 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 89.2 mt -55.18 -55.74 36.09 Favored Pre-proline 0 N--CA 1.466 0.352 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 6.0 Cg_exo -46.67 -45.28 20.22 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.055 2.503 . . . . 0.0 112.986 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -65.66 -41.89 91.99 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.061 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.464 HG22 ' O ' ' C' ' 81' ' ' GLY . 88.0 t -63.82 -42.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.561 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.77 -29.42 68.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.924 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 54.4 m -67.05 -23.78 65.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.471 0.653 . . . . 0.0 109.524 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.403 HD12 HG11 ' A' ' 12' ' ' VAL . 66.9 tp -78.15 -25.6 47.38 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.78 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.561 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 10.2 mmm-85 -72.5 -31.14 65.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -76.26 -40.81 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.474 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' C' ' 87' ' ' SER . 97.4 mm-40 -65.82 -34.45 78.18 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.534 HG23 ' O ' ' C' ' 89' ' ' ARG . 1.1 m -74.59 -28.99 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.468 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -65.94 -32.44 73.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' C' ' 91' ' ' GLN . . . -67.53 -52.53 37.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.912 178.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.75 -34.44 67.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.119 178.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.529 ' O ' HG11 ' C' ' 99' ' ' VAL . 22.0 tt0 -69.68 -48.07 60.99 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.655 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.438 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -59.39 -29.62 66.6 Favored Glycine 0 C--O 1.237 0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.545 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.727 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -74.17 -50.44 19.29 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.406 -0.397 . . . . 0.0 111.047 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.529 HG11 ' O ' ' C' ' 96' ' ' GLN . 14.9 p -67.5 -31.88 54.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 17.0 pt20 -70.02 -42.3 73.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.942 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.4 ' HD1' ' HA ' ' C' ' 98' ' ' GLN . 6.4 p-80 -77.58 -18.1 57.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.589 -0.845 . . . . 0.0 110.253 179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.6 mt -71.26 -39.57 71.51 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.441 ' HG2' HD22 ' B' ' 62' ' ' LEU . 0.7 OUTLIER -71.1 -34.99 71.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.27 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.89 -56.07 26.36 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.425 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.419 ' HB2' ' HE2' ' C' ' 109' ' ' TYR . . . -62.7 -38.28 89.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.584 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.496 ' HD1' ' HB2' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -56.89 -26.12 58.26 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.439 179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.1 t -50.37 -32.66 18.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.095 0.474 . . . . 0.0 109.951 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.749 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 15.9 mm100 -87.68 -53.02 5.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.645 177.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.824 ' HA ' HG23 ' C' ' 112' ' ' VAL . 13.2 m-85 -61.6 -20.54 63.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.464 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 14.5 mttp -65.91 -36.06 82.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.635 0.255 . . . . 0.0 110.686 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -99.3 33.03 2.54 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.157 0.503 . . . . 0.0 111.055 179.241 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.824 HG23 ' HA ' ' C' ' 109' ' ' TYR . 60.0 t -96.94 -43.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.852 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.616 ' HB2' HG22 ' B' ' 72' ' ' VAL . 6.4 tt0 -120.47 105.66 11.08 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 122.45 1.119 . . . . 0.0 109.741 176.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -168.35 -34.27 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 112.783 -2.008 . . . . 0.0 108.84 -178.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.788 ' CD1' ' HD3' ' C' ' 116' ' ' PRO . 6.4 p90 -78.82 -39.21 1.5 Allowed Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.603 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.788 ' HD3' ' CD1' ' C' ' 115' ' ' PHE . 21.1 Cg_endo -95.56 -159.0 0.05 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 122.403 2.069 . . . . 0.0 111.334 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -146.57 84.22 1.62 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 65.24 -129.99 34.88 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.425 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.21 -91.37 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.956 -0.64 . . . . 0.0 111.733 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.49 HG22 HD12 ' C' ' 120' ' ' ILE . 4.6 tt . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.342 179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.413 ' O ' HG21 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.496 ' HB3' ' HD3' ' A' ' 3' ' ' PRO . 3.2 tm? -60.7 -53.42 64.5 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.366 -0.349 . . . . 0.0 110.751 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' A' ' 2' ' ' LEU . 78.4 Cg_exo -42.32 -44.72 7.91 Favored 'Trans proline' 0 C--N 1.363 1.314 0 C-N-CA 123.135 2.556 . . . . 0.0 113.197 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.21 -43.92 97.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.638 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.413 HG21 ' O ' ' A' ' 1' ' ' GLY . 46.6 t -61.58 -47.3 93.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.062 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.696 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.12 -24.17 65.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.282 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.685 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -68.04 -29.01 67.89 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-O 121.721 0.772 . . . . 0.0 109.125 178.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 51.1 tp -75.75 -22.4 56.54 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.152 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.696 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 41.3 mmm-85 -65.77 -37.58 86.72 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.03 -43.79 81.9 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.656 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.514 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.9 tt0 -63.6 -31.3 72.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.89 0.852 . . . . 0.0 109.61 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.55 -28.91 29.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.769 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.784 ' HA ' HE21 ' A' ' 16' ' ' GLN . 58.0 mt-10 -68.15 -29.47 68.36 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.514 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.01 -55.4 12.76 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.314 177.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.8 -36.84 77.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.827 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.784 HE21 ' HA ' ' A' ' 13' ' ' GLU . 24.7 pt20 -75.13 -26.83 59.48 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.181 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.585 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -68.63 -33.49 76.4 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 177.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.717 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 93.1 mm-40 -70.76 -48.62 53.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.837 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 16' ' ' GLN . 6.1 p -67.43 -33.96 65.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.585 HE21 ' HA2' ' A' ' 17' ' ' GLY . 15.9 pt20 -66.6 -45.7 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.941 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.564 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.9 p-80 -74.57 -17.52 60.71 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 119.736 -0.786 . . . . 0.0 110.433 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.717 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.8 mt -72.05 -37.8 69.6 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.585 ' HG2' HD22 ' C' ' 102' ' ' LEU . 74.1 mt-30 -70.88 -30.38 66.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.564 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.43 -59.19 5.52 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.465 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.613 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.43 -39.68 91.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.117 178.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -56.27 -26.61 52.41 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -59.22 -28.18 66.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.822 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.619 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 14.5 mm100 -89.59 -33.87 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.613 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 21.6 m-85 -78.45 -18.4 54.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.581 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.477 ' HA ' ' OH ' ' C' ' 109' ' ' TYR . 8.5 tmtt? -55.47 -46.73 76.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.303 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.666 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -91.13 37.29 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.408 0.623 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 32' ' ' VAL . 96.2 t -121.19 3.85 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.97 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.56 ' HB3' ' CE1' ' C' ' 109' ' ' TYR . 9.5 pt-20 -93.85 -27.63 16.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 O-C-N 121.681 -0.637 . . . . 0.0 112.288 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.646 HD22 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -54.99 -27.27 42.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.479 0.657 . . . . 0.0 110.499 179.422 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.944 ' HB3' ' HD2' ' A' ' 36' ' ' PRO . 43.2 m-85 -55.61 179.33 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.404 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.944 ' HD2' ' HB3' ' A' ' 35' ' ' PHE . 38.6 Cg_endo -67.47 174.61 7.07 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.627 2.218 . . . . 0.0 113.634 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -104.58 143.65 32.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.897 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.564 ' HA3' HD13 ' C' ' 114' ' ' LEU . . . -95.1 -65.99 0.99 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.461 -0.876 . . . . 0.0 111.566 179.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.429 ' H ' ' HB2' ' C' ' 111' ' ' LYS . . . -93.28 -76.93 1.35 Allowed Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.243 0.725 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.424 178.346 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . 0.411 ' O ' HG21 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.987 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.498 ' HB3' ' HD3' ' B' ' 43' ' ' PRO . 3.2 tm? -60.32 -53.35 65.66 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.491 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . 0.498 ' HD3' ' HB3' ' B' ' 42' ' ' LEU . 64.4 Cg_exo -42.37 -44.72 8.02 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 123.161 2.574 . . . . 0.0 113.323 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.54 -43.34 99.06 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.484 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.411 HG21 ' O ' ' B' ' 41' ' ' GLY . 46.0 t -61.92 -47.25 94.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.875 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.716 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.34 -23.65 65.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.157 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 68.1 m -68.38 -28.41 67.08 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.856 0.836 . . . . 0.0 109.35 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.415 HD21 ' HD2' ' C' ' 89' ' ' ARG . 54.3 tp -76.61 -22.54 54.04 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.885 178.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.716 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 41.7 mmm-85 -65.25 -38.59 90.8 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -66.58 -43.8 83.95 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.048 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.508 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 38.6 tt0 -62.96 -31.87 73.07 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.983 0.897 . . . . 0.0 109.377 178.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -29.58 32.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.841 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . 0.727 ' HA ' HE21 ' B' ' 56' ' ' GLN . 54.9 mt-10 -67.45 -28.37 67.82 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.01 -55.69 10.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.18 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -59.27 -37.46 77.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.739 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.727 HE21 ' HA ' ' B' ' 53' ' ' GLU . 24.3 pt20 -74.43 -27.36 60.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.487 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.584 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -68.7 -32.78 74.74 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.732 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 94.4 mm-40 -70.65 -49.2 49.89 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 121.017 0.437 . . . . 0.0 111.011 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.571 HG12 ' HA ' ' B' ' 56' ' ' GLN . 5.7 p -67.2 -33.95 66.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.584 HE21 ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -66.41 -45.6 79.38 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.119 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.551 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 7.3 p-80 -74.62 -17.76 60.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.451 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.8 mt -71.93 -38.46 69.85 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.589 ' HG2' HD22 ' A' ' 22' ' ' LEU . 73.7 mt-30 -70.23 -30.95 68.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.21 -58.13 9.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.722 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.612 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.05 -40.0 94.28 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.082 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.435 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.55 -25.9 53.38 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.083 -179.849 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -59.71 -28.92 67.74 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.639 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . 0.659 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 14.5 mm100 -89.07 -33.35 17.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.753 0.311 . . . . 0.0 111.007 179.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.612 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.8 m-85 -78.84 -17.48 55.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.694 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.486 ' HA ' ' OH ' ' A' ' 29' ' ' TYR . 8.7 tmtt? -56.31 -47.32 78.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.377 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.677 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.5 OUTLIER -90.09 37.23 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.184 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.608 HG12 ' O ' ' B' ' 72' ' ' VAL . 99.4 t -120.84 2.63 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.074 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.557 ' HB3' ' CE1' ' A' ' 29' ' ' TYR . 9.5 pt-20 -93.02 -26.76 17.37 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.599 -0.688 . . . . 0.0 112.194 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.628 HD22 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -55.36 -26.54 41.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.363 0.601 . . . . 0.0 110.295 179.678 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.949 ' HB3' ' HD2' ' B' ' 76' ' ' PRO . 42.0 m-85 -56.23 178.67 0.13 Allowed Pre-proline 0 CA--C 1.546 0.799 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.482 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.949 ' HD2' ' HB3' ' B' ' 75' ' ' PHE . 37.9 Cg_endo -66.92 175.56 5.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.464 2.109 . . . . 0.0 113.391 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -105.17 143.13 33.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.691 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . 0.415 ' HA3' ' HG ' ' A' ' 34' ' ' LEU . . . -94.81 -63.08 1.01 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.638 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.427 ' H ' ' HB2' ' A' ' 31' ' ' LYS . . . -96.49 -75.59 1.26 Allowed Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.245 0.86 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.298 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . 0.409 ' O ' HG21 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.2 -0.36 . . . . 0.0 112.2 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.499 ' HB3' ' HD3' ' C' ' 83' ' ' PRO . 3.3 tm? -59.68 -53.11 68.87 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.733 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.499 ' HD3' ' HB3' ' C' ' 82' ' ' LEU . 69.4 Cg_exo -42.68 -44.16 8.71 Favored 'Trans proline' 0 C--N 1.363 1.298 0 C-N-CA 123.1 2.533 . . . . 0.0 113.36 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -63.05 -43.33 98.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.671 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.409 HG21 ' O ' ' C' ' 81' ' ' GLY . 47.0 t -62.01 -46.29 96.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.855 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.664 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.59 -25.97 66.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.196 179.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.652 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 66.7 m -66.64 -28.56 68.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.745 0.783 . . . . 0.0 109.237 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.616 ' O ' HG13 ' C' ' 92' ' ' VAL . 46.5 tp -75.76 -25.07 56.16 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.116 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.664 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 34.8 mmm-85 -65.43 -35.88 82.25 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.652 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.34 -43.26 82.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.364 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.42 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.3 tt0 -63.6 -32.43 73.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.75 178.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.616 HG13 ' O ' ' C' ' 88' ' ' LEU . 6.0 m -74.91 -23.05 17.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.879 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.755 ' HA ' HE21 ' C' ' 96' ' ' GLN . 55.8 mt-10 -67.96 -29.81 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.46 -55.1 11.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.135 178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . 0.424 ' O ' HG22 ' C' ' 99' ' ' VAL . 3.4 mm? -59.1 -37.92 78.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.685 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.755 HE21 ' HA ' ' C' ' 93' ' ' GLU . 24.1 pt20 -73.78 -28.03 61.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.412 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.714 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -67.09 -33.07 82.28 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.724 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 92.6 mm-40 -70.15 -47.26 62.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.159 -0.52 . . . . 0.0 110.422 178.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.642 HG21 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.735 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.714 HE21 ' HA2' ' C' ' 97' ' ' GLY . 17.4 pt20 -59.7 -44.84 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.455 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.551 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 7.2 p-80 -76.83 -18.82 58.15 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.504 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.724 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.2 mt -70.93 -38.24 72.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.632 ' HG2' HD22 ' B' ' 62' ' ' LEU . 72.9 mt-30 -72.08 -30.07 64.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.551 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.96 -57.7 11.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.468 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.633 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.62 -40.3 96.54 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.828 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.421 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.15 -25.82 47.87 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.346 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 13.1 t -60.28 -27.83 67.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 0.0 110.72 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . 0.652 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 14.6 mm100 -89.75 -32.69 16.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.828 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.633 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 22.1 m-85 -79.17 -18.29 53.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.664 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.474 ' HA ' ' OH ' ' B' ' 69' ' ' TYR . 9.0 tmtt? -55.46 -47.33 76.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.62 -179.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.701 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.4 OUTLIER -90.12 38.08 0.92 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.419 0.628 . . . . 0.0 111.111 179.626 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.588 ' O ' HG12 ' C' ' 112' ' ' VAL . 92.7 t -122.15 2.66 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.339 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.522 ' HB3' ' CE1' ' B' ' 69' ' ' TYR . 9.8 pt-20 -92.04 -29.55 16.52 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.355 -0.841 . . . . 0.0 112.452 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.564 HD13 ' HA3' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -53.88 -24.3 15.52 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 124.033 0.933 . . . . 0.0 110.539 178.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.979 ' HB3' ' HD2' ' C' ' 116' ' ' PRO . 43.2 m-85 -61.07 -178.87 0.19 Allowed Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.618 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.979 ' HD2' ' HB3' ' C' ' 115' ' ' PHE . 37.6 Cg_endo -67.17 176.76 4.31 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.361 2.04 . . . . 0.0 113.269 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -106.23 143.14 34.78 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.825 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -93.75 -66.51 1.05 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.249 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . 0.414 ' H ' ' HB2' ' B' ' 71' ' ' LYS . . . -94.27 -73.91 1.23 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.537 -0.84 . . . . 0.0 111.074 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.242 0.698 0 CA-C-O 118.592 -0.718 . . . . 0.0 109.319 178.668 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.185 -0.366 . . . . 0.0 112.185 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.2 mp -57.73 -54.74 52.15 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 119.109 -0.472 . . . . 0.0 111.804 179.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -44.36 -42.02 13.65 Favored 'Trans proline' 0 C--N 1.362 1.269 0 C-N-CA 122.726 2.284 . . . . 0.0 112.884 -179.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -64.59 -37.28 87.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.074 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.51 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 44.4 t -66.05 -41.04 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.452 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.53 -34.95 74.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.312 0.577 . . . . 0.0 109.681 178.915 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.703 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.9 m -71.9 -19.54 61.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.987 0.898 . . . . 0.0 108.695 177.398 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.51 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 36.6 tp -72.62 -28.05 62.52 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.442 179.663 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 29.8 mmm-85 -62.42 -22.71 66.39 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.975 179.075 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.703 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.2 mt-30 -74.28 -35.66 63.76 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.84 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 99.0 mm-40 -71.53 -25.53 62.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 178.16 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.506 HG21 ' O ' ' A' ' 8' ' ' LEU . 60.1 t -75.42 -40.26 42.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.367 178.684 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -62.17 -33.55 74.74 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 11' ' ' GLN . . . -65.73 -55.17 18.76 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 113.974 -1.466 . . . . 0.0 110.772 178.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 78.8 mt -55.11 -45.18 75.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.719 -179.334 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.633 ' HA ' HG22 ' A' ' 19' ' ' VAL . 23.4 pt20 -72.66 -25.2 61.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 -179.553 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.485 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.75 -31.78 76.63 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 177.552 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.485 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 14.1 mm100 -71.51 -40.34 70.21 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.112 178.392 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.633 HG22 ' HA ' ' A' ' 16' ' ' GLN . 2.9 t -67.12 -44.98 87.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.523 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.485 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.7 pt20 -61.47 -43.09 99.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.678 -178.548 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.485 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.1 p-80 -77.75 -17.63 57.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.175 -179.667 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.599 ' HG ' ' HE2' ' B' ' 66' ' ' PHE . 1.2 mp -77.12 -35.54 56.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 120.099 -0.641 . . . . 0.0 109.56 178.518 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.622 ' HG2' HD21 ' C' ' 102' ' ' LEU . 66.2 mt-30 -74.97 -30.63 61.25 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 21' ' ' HIS . . . -58.29 -53.9 53.04 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.229 177.397 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.68 -46.71 86.65 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.508 178.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.427 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -47.88 -33.1 7.04 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 123.86 0.725 . . . . 0.0 112.502 179.558 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t -53.96 -34.01 58.53 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.853 0.358 . . . . 0.0 111.582 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -86.05 -12.77 49.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.865 0.364 . . . . 0.0 111.522 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.697 ' O ' HG21 ' A' ' 32' ' ' VAL . 62.4 m-85 -103.74 -16.03 15.56 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.348 0.594 . . . . 0.0 109.509 179.347 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.59 ' HA ' ' HE2' ' C' ' 109' ' ' TYR . 82.5 mttt -63.49 -17.74 63.07 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.443 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.446 ' HZ1' ' C ' ' B' ' 80' ' ' ILE . 0.2 OUTLIER -102.25 22.82 12.65 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.563 179.03 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.697 HG21 ' O ' ' A' ' 29' ' ' TYR . 4.3 m -119.06 -14.72 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 121.838 -0.539 . . . . 0.0 111.964 179.745 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.466 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 10.7 pt-20 -75.43 -28.63 59.44 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.481 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.466 ' N ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -91.53 -41.61 10.71 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -175.093 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.693 ' HZ ' ' HA3' ' B' ' 78' ' ' GLY . 4.6 m-30 -45.85 -63.77 1.15 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 123.806 0.691 . . . . 0.0 111.35 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.686 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 96.2 Cg_endo -81.34 171.93 13.19 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.458 2.106 . . . . 0.0 111.369 178.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -117.34 -89.41 0.58 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.76 179.443 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.678 ' HA3' ' HZ ' ' C' ' 115' ' ' PHE . . . 69.22 61.8 4.32 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.849 -0.691 . . . . 0.0 111.702 -179.843 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 87.12 -98.24 2.35 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.211 -178.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.443 ' C ' ' HZ1' ' C' ' 111' ' ' LYS . 34.7 pt . . . . . 0 C--O 1.245 0.849 0 CA-C-O 118.506 -0.759 . . . . 0.0 110.461 179.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.968 0 N-CA-C 112.606 -0.197 . . . . 0.0 112.606 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mp -55.73 -55.01 45.35 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-O 119.279 -0.391 . . . . 0.0 112.046 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -44.26 -43.23 13.37 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.87 2.38 . . . . 0.0 112.571 -179.308 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -63.52 -37.68 88.25 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.88 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.5 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 45.0 t -66.12 -40.7 87.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.212 179.444 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -69.77 -35.73 75.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.486 178.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 47' ' ' SER . . . . . 0.709 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 32.8 m -69.99 -19.95 63.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.089 0.947 . . . . 0.0 108.63 177.159 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . 0.5 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 33.4 tp -72.29 -28.92 63.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 49' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 31.5 mmm-85 -61.26 -24.14 66.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.949 179.014 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 50' ' ' GLN . . . . . 0.709 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.1 mt-30 -72.67 -36.74 67.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.984 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 51' ' ' GLN . . . . . 0.517 ' O ' ' HB2' ' B' ' 54' ' ' ALA . 98.9 mm-40 -70.45 -26.13 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.496 178.108 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.478 HG21 ' O ' ' B' ' 48' ' ' LEU . 57.7 t -74.73 -40.72 47.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.357 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.88 -33.75 74.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.573 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 54' ' ' ALA . . . . . 0.517 ' HB2' ' O ' ' B' ' 51' ' ' GLN . . . -65.21 -55.04 20.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.916 178.273 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 77.8 mt -55.53 -44.98 77.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.653 -179.099 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 56' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' B' ' 59' ' ' VAL . 24.1 pt20 -72.83 -24.94 60.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 57' ' ' GLY . . . . . 0.509 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.19 -30.9 73.95 Favored Glycine 0 C--O 1.237 0.302 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.687 ' HB3' HG21 ' C' ' 99' ' ' VAL . 14.1 mm100 -72.02 -41.75 67.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.168 -0.516 . . . . 0.0 109.933 178.433 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.635 HG22 ' HA ' ' B' ' 56' ' ' GLN . 2.9 t -65.42 -46.21 90.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.402 179.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 60' ' ' GLN . . . . . 0.509 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 8.9 pt20 -60.58 -43.01 97.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.762 -178.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 61' ' ' HIS . . . . . 0.477 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.1 p-80 -78.28 -16.82 57.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . 0.617 ' HG ' ' HE2' ' C' ' 106' ' ' PHE . 1.2 mp -77.56 -36.29 52.32 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.402 178.453 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.495 ' HG2' HD11 ' A' ' 22' ' ' LEU . 66.2 mt-30 -73.79 -31.49 63.3 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 64' ' ' ALA . . . . . 0.424 ' HB2' ' O ' ' B' ' 61' ' ' HIS . . . -57.1 -54.4 47.17 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.689 177.111 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 65' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' B' ' 69' ' ' TYR . . . -58.27 -47.12 84.61 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.3 178.413 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 66' ' ' PHE . . . . . 0.599 ' HE2' ' HG ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -47.58 -33.09 6.12 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 123.838 0.711 . . . . 0.0 112.682 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -54.58 -33.85 60.96 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 0.0 111.524 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -86.03 -12.22 50.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.912 0.387 . . . . 0.0 111.472 179.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 69' ' ' TYR . . . . . 0.722 ' O ' HG21 ' B' ' 72' ' ' VAL . 61.9 m-85 -104.05 -16.67 15.22 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.494 0.664 . . . . 0.0 109.327 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.584 ' HA ' ' HE2' ' A' ' 29' ' ' TYR . 83.5 mttt -62.85 -17.97 62.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.407 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.433 ' HZ1' ' C ' ' C' ' 120' ' ' ILE . 0.2 OUTLIER -101.85 22.53 12.8 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.594 178.716 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 72' ' ' VAL . . . . . 0.722 HG21 ' O ' ' B' ' 69' ' ' TYR . 4.2 m -118.89 -14.4 9.22 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 O-C-N 121.871 -0.518 . . . . 0.0 112.028 179.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 73' ' ' GLU . . . . . 0.447 ' HB3' ' CD2' ' A' ' 29' ' ' TYR . 11.5 pt-20 -75.53 -28.55 59.14 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.702 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.43 ' N ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -91.88 -41.62 10.51 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 -175.09 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 75' ' ' PHE . . . . . 0.694 ' HZ ' ' HA3' ' C' ' 118' ' ' GLY . 4.5 m-30 -46.32 -62.73 1.67 Allowed Pre-proline 0 N--CA 1.479 1.015 0 O-C-N 123.533 0.521 . . . . 0.0 111.137 -179.109 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 76' ' ' PRO . . . . . 0.684 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 95.2 Cg_endo -81.43 172.46 12.55 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.445 2.097 . . . . 0.0 111.612 178.671 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.57 -89.48 0.59 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.684 179.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . 0.693 ' HA3' ' HZ ' ' A' ' 35' ' ' PHE . . . 68.83 60.16 5.5 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.002 -179.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.55 -98.69 2.47 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 -178.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . 0.446 ' C ' ' HZ1' ' A' ' 31' ' ' LYS . 35.0 pt . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.538 -0.744 . . . . 0.0 110.863 179.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.821 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' C' C ' 82' ' ' LEU . . . . . 0.536 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 13.1 mt -56.58 -55.01 47.49 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.326 -0.368 . . . . 0.0 111.714 -179.873 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 83' ' ' PRO . . . . . 0.536 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 71.1 Cg_exo -43.31 -42.87 10.44 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.129 2.553 . . . . 0.0 112.657 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -64.82 -36.69 85.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.1 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 85' ' ' VAL . . . . . 0.527 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 47.2 t -66.86 -41.37 87.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.962 179.66 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 86' ' ' ALA . . . . . 0.454 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.86 -35.93 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.393 0.616 . . . . 0.0 109.678 178.831 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 87' ' ' SER . . . . . 0.717 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 44.5 m -70.9 -19.9 62.55 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.057 0.932 . . . . 0.0 108.966 177.265 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 88' ' ' LEU . . . . . 0.527 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 35.9 tp -71.83 -28.56 63.65 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.538 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 89' ' ' ARG . . . . . 0.572 ' HA ' ' CG1' ' C' ' 92' ' ' VAL . 26.2 mmm-85 -63.09 -22.82 67.12 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.041 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 90' ' ' GLN . . . . . 0.717 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.0 OUTLIER -73.77 -35.25 64.96 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.886 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 91' ' ' GLN . . . . . 0.428 ' O ' ' HB2' ' C' ' 94' ' ' ALA . 99.0 mm-40 -70.98 -28.7 64.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.976 177.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 92' ' ' VAL . . . . . 0.572 ' CG1' ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -79.08 -31.49 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 119.982 -0.687 . . . . 0.0 110.359 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 93' ' ' GLU . . . . . 0.444 ' HA ' HE21 ' C' ' 96' ' ' GLN . 46.5 tp10 -63.37 -34.74 78.37 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.915 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 94' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' C' ' 91' ' ' GLN . . . -66.53 -52.43 45.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.244 -1.344 . . . . 0.0 111.256 178.294 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.79 -42.95 80.39 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.788 -1.096 . . . . 0.0 111.464 -179.257 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 96' ' ' GLN . . . . . 0.591 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 25.3 pt20 -74.8 -25.11 58.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.938 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 97' ' ' GLY . . . . . 0.554 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -68.23 -30.6 73.72 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 177.421 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 98' ' ' GLN . . . . . 0.55 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 14.6 mm100 -73.31 -43.12 61.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.934 -0.633 . . . . 0.0 110.495 178.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 99' ' ' VAL . . . . . 0.687 HG21 ' HB3' ' B' ' 58' ' ' GLN . 0.2 OUTLIER -71.52 -34.18 52.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.249 -179.399 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 100' ' ' GLN . . . . . 0.554 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.5 pt20 -65.32 -43.18 91.8 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.104 177.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 101' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' C' ' 104' ' ' ALA . 5.6 p-80 -78.5 -17.33 56.4 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.563 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 102' ' ' LEU . . . . . 0.622 HD21 ' HG2' ' A' ' 23' ' ' GLN . 4.0 mt -74.2 -37.82 63.8 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.367 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 103' ' ' GLN . . . . . 0.47 ' HG2' HD11 ' B' ' 62' ' ' LEU . 63.8 mt-30 -72.46 -31.78 65.71 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.584 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 104' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' C' ' 101' ' ' HIS . . . -57.28 -53.79 54.16 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.543 177.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 105' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' C' ' 109' ' ' TYR . . . -59.32 -46.44 88.57 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.556 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 106' ' ' PHE . . . . . 0.617 ' HE2' ' HG ' ' B' ' 62' ' ' LEU . 0.7 OUTLIER -48.19 -32.94 7.73 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.795 0.684 . . . . 0.0 112.119 179.502 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 38.8 t -53.47 -35.7 60.85 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.913 0.387 . . . . 0.0 111.314 -179.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -84.93 -12.95 52.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.894 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 109' ' ' TYR . . . . . 0.71 ' O ' HG21 ' C' ' 112' ' ' VAL . 62.8 m-85 -103.43 -16.18 15.67 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.633 0.73 . . . . 0.0 109.418 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 110' ' ' LYS . . . . . 0.591 ' HA ' ' HE2' ' B' ' 69' ' ' TYR . 82.7 mttt -62.69 -18.46 62.49 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.291 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 111' ' ' LYS . . . . . 0.443 ' HZ1' ' C ' ' A' ' 40' ' ' ILE . 0.2 OUTLIER -101.65 21.85 13.74 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.313 -0.955 . . . . 0.0 111.868 179.046 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 112' ' ' VAL . . . . . 0.71 HG21 ' O ' ' C' ' 109' ' ' TYR . 4.4 m -118.47 -13.57 10.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 O-C-N 121.893 -0.505 . . . . 0.0 112.285 179.469 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 113' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' C' ' 114' ' ' LEU . 10.6 pt-20 -76.85 -28.83 55.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 114' ' ' LEU . . . . . 0.468 ' N ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -90.84 -41.91 10.93 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.031 -0.986 . . . . 0.0 113.578 -175.492 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' C' C ' 115' ' ' PHE . . . . . 0.687 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 4.6 m-30 -45.48 -64.48 0.89 Allowed Pre-proline 0 N--CA 1.478 0.942 0 O-C-N 123.387 0.43 . . . . 0.0 111.599 -179.264 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 116' ' ' PRO . . . . . 0.687 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 98.0 Cg_endo -80.89 171.24 14.49 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.521 2.148 . . . . 0.0 111.521 178.691 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -116.47 -89.88 0.56 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.843 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 118' ' ' GLY . . . . . 0.694 ' HA3' ' HZ ' ' B' ' 75' ' ' PHE . . . 69.58 60.46 5.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.943 -179.82 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 88.94 -97.17 2.29 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 120' ' ' ILE . . . . . 0.433 ' C ' ' HZ1' ' B' ' 71' ' ' LYS . 33.0 pt . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.169 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.518 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 78.5 t . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.59 -23.64 65.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.093 178.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.681 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 52.8 m -72.73 -21.26 61.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.571 0.7 . . . . 0.0 110.475 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.7 tp -76.56 -18.72 58.52 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 5.6 mpt_? -73.8 -40.21 63.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.564 178.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.681 ' HG3' ' O ' ' A' ' 7' ' ' SER . 4.0 pt20 -71.93 -30.35 65.24 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 37.4 tt0 -69.63 -28.62 66.06 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 122.116 0.96 . . . . 0.0 108.479 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 t -74.48 -32.73 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 114.273 -1.33 . . . . 0.0 109.444 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.584 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 51.0 mt-10 -71.31 -26.54 62.89 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.32 -41.19 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.477 177.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.3 tp -63.47 -38.42 91.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.385 -1.28 . . . . 0.0 110.107 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.3 pt20 -77.0 -21.27 54.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.844 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.5 ' HA2' ' OE1' ' A' ' 20' ' ' GLN . . . -71.36 -33.68 64.28 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.658 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 47.8 mm-40 -70.65 -44.6 66.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.472 -0.364 . . . . 0.0 110.474 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.1 p -70.12 -31.69 48.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.734 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.5 ' OE1' ' HA2' ' A' ' 17' ' ' GLY . 16.9 pt20 -71.91 -38.73 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.4 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.658 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 12.0 p-80 -79.96 -18.0 51.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.197 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.713 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 1.8 mp -79.47 -28.81 41.55 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.531 ' HG2' HD11 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -76.97 -29.11 55.4 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.321 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -60.01 -60.92 3.07 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.581 177.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.53 -41.4 94.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.542 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.713 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.04 -28.12 56.1 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.898 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t -60.07 -31.96 70.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.226 0.536 . . . . 0.0 110.77 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -76.82 -48.16 19.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.586 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.628 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 34.5 m-85 -70.89 -15.55 62.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.537 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 37.2 ttmt -66.17 -40.64 90.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.21 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.98 32.41 2.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.738 0.78 . . . . 0.0 110.123 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 6.6 t -94.81 -36.41 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.265 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.414 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 38.5 tt0 -101.89 103.75 14.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 122.493 1.14 . . . . 0.0 110.498 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.428 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.3 -1.553 0 CA-C-N 112.566 -2.106 . . . . 0.0 108.991 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.517 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 70.7 t . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.52 -23.97 65.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.158 178.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.9 m -72.21 -22.09 61.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.436 0.636 . . . . 0.0 110.526 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 23.4 tp -75.82 -18.51 59.45 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 5.4 mpt_? -74.1 -39.38 63.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.516 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.7 pt20 -72.42 -30.77 64.93 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.6 tt0 -69.14 -28.25 66.28 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.105 0.955 . . . . 0.0 108.518 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -75.32 -32.74 26.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 114.44 -1.254 . . . . 0.0 109.453 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.573 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 49.0 mt-10 -70.94 -26.39 63.17 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.92 -42.03 73.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.447 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 37.1 tp -63.07 -38.38 90.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.334 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 10.7 pt20 -76.95 -20.77 55.74 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.836 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.481 ' HA2' ' OE1' ' B' ' 60' ' ' GLN . . . -72.13 -33.64 62.02 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 177.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.637 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 45.3 mm-40 -70.04 -44.75 68.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.954 0.407 . . . . 0.0 110.357 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.2 p -69.89 -32.12 50.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.891 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.481 ' OE1' ' HA2' ' B' ' 57' ' ' GLY . 16.8 pt20 -71.89 -38.77 69.93 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.347 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.637 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 11.3 p-80 -79.78 -17.68 52.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.41 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.732 ' O ' ' HB2' ' B' ' 66' ' ' PHE . 1.9 mp -79.93 -29.12 39.67 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.55 ' HG2' HD11 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -75.85 -29.22 58.49 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.322 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -59.85 -61.66 2.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.627 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.43 -41.53 89.78 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.66 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.732 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.94 -29.15 59.69 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.108 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.5 t -58.56 -34.06 70.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.004 0.366 . . . . 0.0 110.648 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.431 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 60.8 mm-40 -75.21 -47.92 25.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.328 0.585 . . . . 0.0 109.9 178.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.622 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 33.9 m-85 -70.94 -16.13 62.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 37.1 ttmt -66.51 -39.98 88.97 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.443 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.482 ' H ' ' HG3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -98.23 31.39 2.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.684 0.754 . . . . 0.0 109.908 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.622 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -93.82 -36.66 7.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.267 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -102.25 101.86 12.19 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.532 1.158 . . . . 0.0 111.145 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.416 ' CD2' ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.722 0 CA-C-N 112.411 -2.177 . . . . 0.0 108.837 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.559 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 76.3 t . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.55 -24.14 65.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.247 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 56.1 m -72.01 -22.02 61.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.539 0.685 . . . . 0.0 110.207 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.696 ' O ' HG13 ' C' ' 92' ' ' VAL . 25.6 tp -75.69 -19.12 59.34 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.693 ' O ' HG22 ' C' ' 92' ' ' VAL . 4.6 mpt_? -75.94 -36.94 59.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.313 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 4.0 pt20 -73.26 -29.49 62.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.464 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.5 tt0 -69.77 -30.33 67.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 177.042 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.696 HG13 ' O ' ' C' ' 88' ' ' LEU . 16.0 m -75.85 -27.9 18.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.738 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.563 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 52.3 mt-10 -70.26 -28.17 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -70.11 -41.0 74.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.542 177.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 40.2 tp -63.77 -37.52 87.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.27 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.563 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 10.9 pt20 -77.69 -21.35 52.16 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.727 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.495 ' HA2' ' OE1' ' C' ' 100' ' ' GLN . . . -71.22 -34.07 64.51 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.661 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 43.1 mm-40 -69.84 -44.87 69.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.317 178.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' C' ' 96' ' ' GLN . 10.0 p -70.22 -30.99 45.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.104 -0.639 . . . . 0.0 112.204 -178.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.495 ' OE1' ' HA2' ' C' ' 97' ' ' GLY . 16.4 pt20 -72.69 -38.86 67.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.001 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.661 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 12.3 p-80 -80.07 -17.16 53.41 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 119.448 -0.901 . . . . 0.0 110.21 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' C' ' 106' ' ' PHE . 1.8 mp -79.79 -29.27 40.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -76.91 -28.83 55.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 176.359 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.84 -61.86 2.3 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.514 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.517 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.12 -41.5 88.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.648 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.647 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.01 -31.44 61.05 Favored 'General case' 0 C--O 1.204 -1.313 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.724 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.4 t -55.74 -34.62 65.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.902 0.382 . . . . 0.0 110.728 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.414 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 55.4 mm-40 -75.38 -49.11 20.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.302 0.572 . . . . 0.0 109.967 178.336 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.616 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 32.7 m-85 -70.36 -16.13 62.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.792 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' C' ' 106' ' ' PHE . 30.1 ttmt -69.32 -34.67 75.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.647 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.469 ' H ' ' HG3' ' C' ' 111' ' ' LYS . 0.0 OUTLIER -101.5 30.66 4.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.452 0.644 . . . . 0.0 109.582 177.721 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.616 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.2 t -93.47 -37.25 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.337 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 37.2 tt0 -101.45 102.71 13.55 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-O 122.404 1.097 . . . . 0.0 110.559 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.428 ' CD2' ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.63 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.792 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.734 0.302 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.67 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.86 -27.34 68.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.511 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 75.2 m -67.7 -28.46 67.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.07 0.462 . . . . 0.0 109.847 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.2 tp -75.48 -21.66 57.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.622 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.719 ' HA ' HG22 ' A' ' 12' ' ' VAL . 39.0 mmm-85 -65.4 -21.53 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.3 mt-30 -73.39 -42.83 61.66 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -70.86 -29.29 65.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.782 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.719 HG22 ' HA ' ' A' ' 9' ' ' ARG . 28.3 m -76.42 -40.87 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.634 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.82 -24.13 61.67 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -55.29 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.552 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' B' ' 56' ' ' GLN . 12.3 tp -58.92 -34.12 71.36 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.295 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 15.4 tt0 -67.12 -38.31 85.37 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.484 179.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -61.4 -31.72 78.39 Favored Glycine 0 C--O 1.237 0.324 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.753 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.684 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 95.6 mm-40 -72.94 -49.95 26.37 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.519 HG11 HD22 ' C' ' 95' ' ' LEU . 10.2 p -66.41 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.3 pt20 -68.88 -42.97 76.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.099 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.544 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.8 p-80 -75.81 -17.29 59.9 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.8 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.684 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 12.3 mt -73.57 -37.3 65.56 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 176.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.6 tm0? -70.65 -29.26 65.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.38 -62.13 2.07 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.086 178.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.478 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.18 -41.15 92.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.08 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.609 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -56.04 -28.98 59.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.12 -179.85 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.0 t -61.6 -31.88 71.96 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.028 0.442 . . . . 0.0 110.259 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.97 -52.04 14.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.59 0.71 . . . . 0.0 109.508 178.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.534 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 56.8 m-85 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.238 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.29 -41.1 98.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.851 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.495 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -96.36 29.67 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.49 0.662 . . . . 0.0 111.272 179.56 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.554 HG21 ' HB2' ' B' ' 73' ' ' GLU . 3.5 t -96.3 -41.12 11.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.594 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.729 ' HB2' HG11 ' C' ' 112' ' ' VAL . 19.3 tt0 -102.74 105.43 15.87 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.63 0.729 . . . . 0.0 109.833 177.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.414 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.615 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.36 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 86.4 t . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.644 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.24 -27.62 68.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.443 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.664 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 69.7 m -67.68 -27.89 67.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.011 0.434 . . . . 0.0 109.965 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.46 -21.56 58.0 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.574 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.734 ' HA ' HG22 ' B' ' 52' ' ' VAL . 39.5 mmm-85 -65.38 -21.97 66.74 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.664 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.0 mt-30 -72.99 -42.09 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.623 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -71.85 -28.48 63.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.51 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' B' ' 49' ' ' ARG . 30.4 m -77.06 -42.25 31.65 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.444 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.95 -25.3 63.57 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.13 -55.2 17.59 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.623 HD11 ' HA ' ' C' ' 96' ' ' GLN . 12.5 tp -59.27 -33.5 71.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.382 -1.281 . . . . 0.0 110.251 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.59 ' HA ' HD11 ' A' ' 15' ' ' LEU . 14.3 tt0 -67.15 -39.2 86.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.521 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.507 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -61.06 -31.72 77.72 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.766 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.701 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 96.0 mm-40 -72.76 -49.5 30.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.02 0.438 . . . . 0.0 111.114 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.445 HG12 ' HA ' ' B' ' 56' ' ' GLN . 9.8 p -66.99 -32.18 56.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 8.0 pt20 -69.96 -42.87 72.6 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.986 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.539 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.8 p-80 -75.74 -17.29 59.96 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.671 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 12.0 mt -73.34 -37.11 66.22 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.495 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.2 tm0? -70.6 -29.98 66.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.39 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.068 178.282 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.459 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.37 -40.99 88.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.134 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.618 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.2 OUTLIER -56.62 -28.7 61.06 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.225 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.1 t -62.0 -30.68 71.11 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.212 0.53 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -75.07 -51.21 14.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.584 0.706 . . . . 0.0 109.389 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 61.0 m-85 -66.28 -16.42 64.01 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.299 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.67 -41.79 98.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.879 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.505 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -95.83 29.42 2.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.362 0.601 . . . . 0.0 111.543 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' C' ' 113' ' ' GLU . 3.6 t -96.28 -40.24 10.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.457 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.554 ' HB2' HG21 ' A' ' 32' ' ' VAL . 19.1 tt0 -103.68 105.36 15.56 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 122.011 0.91 . . . . 0.0 109.922 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.407 ' CD2' ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.658 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.316 -179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.456 -0.163 0 CA-C-O 120.572 0.225 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.686 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.42 -26.97 68.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.394 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 75.5 m -68.07 -28.32 67.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 0.0 109.956 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.36 -21.54 58.26 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.333 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.686 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 42.6 mmm-85 -63.92 -23.65 67.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.694 178.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' C' ' 87' ' ' SER . 3.0 mt-30 -72.48 -44.55 62.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.169 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -69.26 -27.46 65.45 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.788 0.804 . . . . 0.0 110.795 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.27 -45.11 35.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.525 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.4 -21.8 61.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -55.47 13.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.375 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.519 HD22 HG11 ' A' ' 19' ' ' VAL . 1.4 mt -56.46 -38.18 71.31 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.118 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.623 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.0 tt0 -64.23 -38.98 92.97 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.163 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.503 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.88 -31.65 79.12 Favored Glycine 0 C--O 1.238 0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.587 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.697 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 96.2 mm-40 -73.04 -50.04 25.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 111.189 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.492 HG12 ' HA ' ' C' ' 96' ' ' GLN . 9.6 p -66.37 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 8.0 pt20 -68.94 -43.41 75.12 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.026 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.553 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 6.6 p-80 -75.53 -17.06 60.19 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.967 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 12.8 mt -74.25 -36.62 63.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.534 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.1 tm0? -70.94 -29.18 65.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.19 -63.07 1.39 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.829 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.465 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.39 -42.01 90.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.136 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.635 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.2 OUTLIER -55.57 -29.1 58.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.174 -0.921 . . . . 0.0 112.308 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 10.6 t -61.98 -30.62 71.06 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.028 0.442 . . . . 0.0 110.653 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -75.56 -51.1 13.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.594 0.712 . . . . 0.0 109.401 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.634 ' HA ' HG13 ' C' ' 112' ' ' VAL . 58.7 m-85 -66.03 -17.38 64.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.016 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -60.76 -39.49 88.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.08 -0.963 . . . . 0.0 110.907 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.501 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.56 26.64 4.83 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.729 HG11 ' HB2' ' A' ' 33' ' ' GLU . 1.1 m -99.41 -30.58 3.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.816 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.542 ' HB2' HG21 ' B' ' 72' ' ' VAL . 18.4 tt0 -102.95 103.22 13.33 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 121.922 0.868 . . . . 0.0 109.566 176.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.408 ' CD2' ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.3 -1.573 0 CA-C-N 113.399 -1.728 . . . . 0.0 110.329 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.563 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 85.2 t . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.681 0.277 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.28 -33.47 69.79 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.708 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -69.45 -20.25 63.76 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.416 1.103 . . . . 0.0 108.294 177.02 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 28.6 tp -76.3 -29.65 57.43 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.323 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.606 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 22.6 mmm-85 -66.37 -39.94 89.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.074 0.464 . . . . 0.0 109.997 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.708 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -69.76 -41.93 74.54 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.14 179.694 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 61.1 tt0 -66.62 -34.94 79.0 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.104 0.478 . . . . 0.0 111.377 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 9' ' ' ARG . 5.7 p -76.97 -30.88 18.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -69.98 -30.56 67.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.47 -56.29 13.22 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.716 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.2 tp -58.39 -34.52 70.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.054 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.458 ' HA ' HD11 ' C' ' 95' ' ' LEU . 19.7 tt0 -65.27 -44.29 88.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.688 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.526 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -61.13 -31.31 76.33 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.625 179.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 69.8 mt-30 -71.95 -43.71 64.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.898 0.38 . . . . 0.0 110.584 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.2 t -67.52 -40.93 85.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.839 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 20.8 pt20 -61.98 -42.12 98.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.059 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.3 p-80 -79.78 -17.16 54.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.771 -0.772 . . . . 0.0 111.024 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 11.5 mt -71.64 -41.19 69.1 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -70.82 -31.97 68.88 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.66 -55.43 34.98 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.755 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.673 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.89 -39.94 93.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.693 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.416 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -55.05 -29.67 57.97 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.381 179.43 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -49.83 -26.87 4.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.029 0.442 . . . . 0.0 111.122 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.451 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 55.8 mm-40 -96.66 -42.82 7.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.921 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.1 m-85 -73.58 -20.4 60.63 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -178.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 51.5 mtmt -70.38 -26.95 63.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.78 0.324 . . . . 0.0 110.64 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.64 31.6 5.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.74 0.781 . . . . 0.0 109.738 178.566 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.631 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 2.9 t -93.38 -42.12 12.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.238 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -97.71 100.05 11.43 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 122.336 1.065 . . . . 0.0 110.687 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.69 0 CA-C-N 112.742 -2.026 . . . . 0.0 109.615 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.535 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 99.9 t . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.77 0.319 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -71.2 -33.74 70.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 48.3 m -69.51 -20.6 63.71 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 122.373 1.082 . . . . 0.0 108.611 176.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.535 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 28.7 tp -75.95 -30.04 58.52 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.033 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 22.6 mmm-85 -66.21 -39.12 89.39 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.158 0.504 . . . . 0.0 110.319 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -70.24 -42.65 71.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.016 179.851 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 61.8 tt0 -65.55 -35.58 81.26 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.455 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.502 HG12 ' O ' ' B' ' 49' ' ' ARG . 5.4 p -76.52 -30.24 19.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.757 -178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.86 -29.88 66.11 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -66.43 -56.3 11.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.454 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' C' ' 96' ' ' GLN . 27.3 tp -58.0 -34.47 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.039 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.442 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.4 tt0 -65.21 -45.09 86.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.571 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -60.07 -31.91 74.24 Favored Glycine 0 C--O 1.236 0.26 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.605 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.8 mt-30 -71.3 -44.01 65.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 110.681 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.0 t -67.35 -40.18 84.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 22.1 pt20 -63.2 -41.95 99.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.339 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.476 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.99 -18.11 54.23 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.676 -0.809 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 11.4 mt -71.14 -40.33 71.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.647 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -71.8 -31.77 66.91 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.7 -55.41 35.19 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.847 177.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.686 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.88 -40.91 97.02 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.636 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -54.73 -29.12 52.66 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.573 179.306 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.8 t -50.35 -27.76 6.81 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 111.109 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 52.6 mm-40 -95.41 -42.47 8.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.893 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.686 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 15.2 m-85 -74.06 -19.49 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 51.7 mtmt -71.11 -26.62 63.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.612 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -106.69 31.57 5.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.682 0.753 . . . . 0.0 109.666 178.509 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 3.0 t -93.44 -42.51 13.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.991 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 38.3 tt0 -96.86 100.7 12.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.229 1.014 . . . . 0.0 110.846 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.7 0 CA-C-N 112.653 -2.067 . . . . 0.0 109.795 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.588 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 96.0 t . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.25 -34.52 70.83 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.723 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.2 m -69.23 -20.79 63.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.264 1.031 . . . . 0.0 108.312 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.789 ' O ' HG22 ' C' ' 92' ' ' VAL . 30.2 tp -74.64 -31.7 62.05 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.991 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.588 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 23.5 mmm-85 -64.87 -40.15 94.69 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.663 0.602 . . . . 0.0 110.524 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.723 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.83 -42.0 82.14 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 64.4 tt0 -64.76 -37.05 86.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.077 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.789 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -70.79 -38.82 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.603 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.35 -31.13 71.72 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -67.1 -57.54 6.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.792 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.493 ' O ' HG23 ' C' ' 99' ' ' VAL . 26.7 tp -57.83 -34.69 69.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.297 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.493 ' HA ' HD11 ' B' ' 55' ' ' LEU . 21.7 tt0 -65.23 -44.83 86.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.489 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.425 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.21 -31.55 73.73 Favored Glycine 0 C--O 1.238 0.388 0 N-CA-C 111.629 -0.588 . . . . 0.0 111.629 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 71.9 mt-30 -72.52 -43.65 63.27 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.643 -0.328 . . . . 0.0 110.532 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.493 HG23 ' O ' ' C' ' 95' ' ' LEU . 59.6 t -67.63 -40.11 83.49 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.425 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 3.7 pt20 -62.87 -42.37 99.74 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.313 -0.155 . . . . 0.0 111.12 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.51 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 6.6 p-80 -79.24 -17.32 54.99 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.966 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 11.0 mt -71.51 -40.73 69.96 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 177.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.19 -32.27 68.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.185 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.54 -54.95 41.01 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.936 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.692 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.28 -40.34 95.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.554 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.52 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -54.89 -29.32 55.47 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.473 179.028 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.8 t -49.64 -27.19 4.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.91 0.386 . . . . 0.0 111.298 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.432 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 52.3 mm-40 -96.16 -43.31 7.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.924 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.692 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 14.4 m-85 -73.38 -20.36 60.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.52 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 49.8 mtmt -70.74 -25.8 63.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.675 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.475 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -108.48 32.8 4.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.823 0.82 . . . . 0.0 109.516 178.147 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 3.0 t -93.79 -42.87 13.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.861 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.536 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 32.3 tt0 -96.73 99.55 11.14 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.35 1.072 . . . . 0.0 111.149 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.536 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.767 0 CA-C-N 112.523 -2.126 . . . . 0.0 109.397 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 84.0 t . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.778 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.88 -27.97 62.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.606 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 57.1 p -72.64 -19.63 61.41 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.481 HD11 HG11 ' B' ' 52' ' ' VAL . 57.9 tp -78.96 -24.13 44.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.354 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.778 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -65.82 -47.69 74.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.759 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.6 OUTLIER -65.37 -42.19 92.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.95 179.54 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -62.04 -34.32 76.02 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.374 0.607 . . . . 0.0 110.141 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.492 HG11 HD11 ' C' ' 88' ' ' LEU . 1.2 t -77.46 -31.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.299 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 51.5 mt-10 -66.88 -30.41 70.57 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -53.1 27.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.316 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 74.7 mt -58.8 -34.21 71.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.151 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.63 -46.86 74.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.502 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.537 ' HA2' ' NE2' ' A' ' 20' ' ' GLN . . . -60.06 -31.9 74.2 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.54 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.0 mt-30 -71.3 -46.88 59.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.839 0.352 . . . . 0.0 110.745 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' LEU . 89.5 t -64.46 -42.36 95.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.537 ' NE2' ' HA2' ' A' ' 17' ' ' GLY . 15.0 pt20 -62.36 -42.71 99.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.391 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.422 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 4.6 p-80 -78.01 -16.65 57.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.966 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.2 mt -72.0 -41.96 66.99 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.615 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -66.4 -36.12 82.04 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.369 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.46 -54.9 40.31 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.887 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.05 -41.86 93.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.367 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 4.3 m-85 -53.7 -32.17 50.85 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.646 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.9 t -49.71 -30.53 9.44 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.446 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 13.3 mm100 -91.62 -42.24 10.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.603 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.6 m-85 -73.33 -20.42 60.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.968 0.413 . . . . 0.0 111.37 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.534 ' HD2' ' O ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -63.23 -32.85 74.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.265 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -104.14 23.91 12.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.396 0.617 . . . . 0.0 110.548 178.444 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -93.74 -23.34 5.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.589 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' H ' ' A' ' 34' ' ' LEU . 72.8 tt0 -81.22 -126.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 31' ' ' LYS . 3.0 mt . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.447 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 86.8 t . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.802 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.88 -27.1 61.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.882 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.68 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 49.6 p -73.92 -19.18 60.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.515 HD11 HG11 ' C' ' 92' ' ' VAL . 56.3 tp -78.89 -22.93 45.21 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.239 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.802 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -67.07 -47.66 70.61 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.7 OUTLIER -64.88 -43.07 94.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.774 179.326 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.23 -34.42 75.09 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.609 0.719 . . . . 0.0 110.395 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.481 HG11 HD11 ' A' ' 8' ' ' LEU . 1.1 t -78.08 -30.42 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.366 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 51.6 mt-10 -68.06 -29.52 68.51 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.08 21.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.9 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.495 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -58.56 -34.03 70.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.194 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -67.02 -46.89 73.1 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.655 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.54 ' HA2' ' NE2' ' B' ' 60' ' ' GLN . . . -59.89 -32.05 73.86 Favored Glycine 0 C--O 1.236 0.269 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.478 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 74.5 mt-30 -70.96 -47.55 58.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.764 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 55' ' ' LEU . 94.9 t -64.11 -41.85 93.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.54 ' NE2' ' HA2' ' B' ' 57' ' ' GLY . 14.5 pt20 -62.51 -43.31 99.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.412 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -77.31 -16.67 58.84 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.1 mt -72.01 -41.97 66.94 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.651 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.38 -36.48 82.96 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.615 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.17 -55.42 33.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.665 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.734 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.25 -42.07 90.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.51 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 4.3 m-85 -53.86 -32.7 53.99 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.658 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 47.7 t -48.17 -32.91 7.64 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.068 0.461 . . . . 0.0 111.054 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.448 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 12.8 mm100 -89.63 -41.86 11.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.871 0.367 . . . . 0.0 111.894 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.734 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 41.0 m-85 -72.76 -21.8 60.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.548 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.492 ' O ' ' HD2' ' B' ' 70' ' ' LYS . 0.4 OUTLIER -62.36 -33.63 75.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.187 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.571 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -103.47 23.61 12.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.465 0.65 . . . . 0.0 110.544 178.399 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -93.27 -23.29 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.485 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' B' ' 74' ' ' LEU . 71.9 tt0 -81.28 -127.01 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.206 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.571 HD11 ' HA ' ' B' ' 71' ' ' LYS . 2.7 mt . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.458 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 86.4 t . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.818 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -73.1 -27.34 61.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.855 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 53.8 p -73.13 -19.26 61.17 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 12' ' ' VAL . 55.8 tp -79.19 -23.22 43.99 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.468 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.818 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.6 OUTLIER -66.67 -47.67 71.74 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.876 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.6 OUTLIER -65.23 -42.9 92.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.85 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -61.2 -34.94 75.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.5 0.667 . . . . 0.0 110.249 179.096 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.515 HG11 HD11 ' B' ' 48' ' ' LEU . 1.1 t -77.14 -30.88 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.389 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 53.0 mt-10 -68.1 -30.54 69.74 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.39 -53.1 32.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.172 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.509 ' O ' HG23 ' C' ' 99' ' ' VAL . 70.9 mt -59.02 -34.04 71.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.214 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -67.02 -46.68 73.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.691 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.517 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -60.08 -32.12 74.94 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.732 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 74.6 mt-30 -70.78 -47.58 58.8 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 120.886 0.374 . . . . 0.0 110.775 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.509 HG23 ' O ' ' C' ' 95' ' ' LEU . 87.8 t -64.01 -41.68 93.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.7 pt20 -63.16 -42.38 99.41 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.415 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 5.1 p-80 -78.14 -16.99 57.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.809 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 10.5 mt -71.35 -41.51 69.67 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.634 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -66.65 -36.8 83.43 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -55.68 -54.7 41.01 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.665 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.61 -42.07 96.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.393 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 4.4 m-85 -53.73 -31.75 49.48 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.655 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.5 t -49.77 -32.19 13.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.419 ' O ' ' HE3' ' C' ' 111' ' ' LYS . 13.1 mm100 -89.47 -43.16 11.04 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.642 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 38.0 m-85 -72.7 -20.76 61.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 111.409 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HD2' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -62.48 -29.54 70.61 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -106.22 19.88 19.83 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.074 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.679 HG22 ' O ' ' C' ' 109' ' ' TYR . 34.7 m -92.17 -19.14 7.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.312 177.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -76.46 -124.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.338 0.098 0 CA-C-O 121.765 0.793 . . . . 0.0 112.6 177.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 60.3 t . . . . . 0 CA--C 1.53 0.19 0 CA-C-O 120.77 0.319 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.72 -26.67 62.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.967 0.413 . . . . 0.0 110.551 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 65.1 m -70.89 -19.29 62.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.851 0.834 . . . . 0.0 108.995 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.437 HD11 HG11 ' B' ' 52' ' ' VAL . 67.6 tp -76.64 -23.69 53.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.781 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 1.6 mmt85 -67.98 -32.63 73.18 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -70.87 -47.82 57.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.734 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.518 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 39.5 tt0 -63.25 -32.36 73.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.838 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.633 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.1 p -77.02 -32.52 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.109 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 44.0 mt-10 -70.78 -27.36 63.86 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.81 -53.69 20.17 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.48 -1.237 . . . . 0.0 109.288 178.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 77.0 mt -57.62 -33.33 68.13 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.384 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.457 ' HA ' HG12 ' A' ' 19' ' ' VAL . 17.8 tt0 -69.75 -44.35 70.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.8 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -60.99 -31.52 76.78 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.612 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -73.77 -46.83 43.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 16' ' ' GLN . 13.4 p -69.86 -31.09 46.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.749 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -71.42 -40.47 70.42 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.171 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.1 p-80 -79.77 -18.65 50.53 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.888 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.5 mt -73.37 -39.45 65.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.746 ' HG3' HD11 ' C' ' 102' ' ' LEU . 37.5 tt0 -65.99 -41.36 91.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.326 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.67 -46.79 74.1 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.263 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.713 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.81 -38.13 89.95 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.876 -1.057 . . . . 0.0 110.437 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.758 ' HB3' ' HG3' ' A' ' 30' ' ' LYS . 3.8 m-85 -59.24 -20.52 54.82 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.7 t -55.31 -23.68 24.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.099 0.476 . . . . 0.0 110.589 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.507 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 61.4 mm-40 -107.83 -20.85 13.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.015 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.713 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 27.8 m-85 -96.08 -17.25 21.05 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.758 ' HG3' ' HB3' ' A' ' 26' ' ' PHE . 73.6 mttt -68.42 -29.83 68.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.829 0.347 . . . . 0.0 110.351 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HD3' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -102.32 26.71 7.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.057 0.456 . . . . 0.0 110.303 178.222 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.664 HG23 ' HA ' ' A' ' 29' ' ' TYR . 5.1 t -87.37 -42.87 15.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.464 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 10.6 tt0 -99.86 105.35 17.09 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.224 1.012 . . . . 0.0 111.075 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.439 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 112.718 -2.037 . . . . 0.0 110.618 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.426 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 57.4 t . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.661 0.267 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.21 -26.11 61.91 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.53 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.6 m -71.09 -18.94 62.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.873 0.844 . . . . 0.0 108.982 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.431 HD11 HG11 ' C' ' 92' ' ' VAL . 69.8 tp -76.98 -23.76 52.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.877 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 1.7 mmt85 -67.99 -32.57 73.06 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.517 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.1 OUTLIER -70.84 -49.11 49.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.747 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' B' ' 55' ' ' LEU . 39.7 tt0 -62.42 -31.69 72.43 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -77.56 -32.35 18.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.265 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 44.1 mt-10 -70.9 -27.67 63.96 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.35 -53.98 20.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.258 178.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 78.5 mt -57.87 -32.6 67.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.372 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.432 ' HA ' HG12 ' B' ' 59' ' ' VAL . 16.7 tt0 -70.41 -44.83 67.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.688 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.0 -31.12 75.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.476 179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.5 OUTLIER -73.72 -46.56 45.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.729 0.3 . . . . 0.0 111.489 179.37 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' B' ' 56' ' ' GLN . 13.2 p -70.21 -30.94 45.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.641 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 19.1 pt20 -71.42 -40.86 70.18 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.828 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.531 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.0 p-80 -79.34 -19.11 51.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.656 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.9 mt -73.25 -39.72 65.2 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.564 ' HG3' HD21 ' A' ' 22' ' ' LEU . 37.7 tt0 -65.35 -42.18 93.1 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.1 -46.75 72.17 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.46 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.727 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.393 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.752 ' HB3' ' HG3' ' B' ' 70' ' ' LYS . 3.6 m-85 -58.49 -20.91 49.52 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 39.9 t -54.12 -25.61 23.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.054 0.454 . . . . 0.0 110.495 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.542 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 57.9 mm-40 -106.51 -20.91 13.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.2 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.727 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 26.7 m-85 -95.75 -17.56 21.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' B' ' 66' ' ' PHE . 73.4 mttt -68.27 -30.24 69.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.076 0.465 . . . . 0.0 110.632 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.488 ' HE3' ' HB2' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -101.88 26.61 7.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.298 0.571 . . . . 0.0 110.465 178.426 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.633 HG23 ' HA ' ' B' ' 69' ' ' TYR . 5.0 t -87.63 -42.44 15.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.645 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.507 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 12.4 tt0 -100.62 103.66 14.96 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 122.13 0.967 . . . . 0.0 111.339 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.444 ' CD2' ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.499 0 CA-C-N 112.68 -2.055 . . . . 0.0 110.822 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.42 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 64.8 t . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.798 0.332 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.51 -26.05 62.51 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.001 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.526 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 67.2 m -71.82 -18.5 62.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.893 0.854 . . . . 0.0 108.849 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.467 HD11 HG11 ' A' ' 12' ' ' VAL . 65.6 tp -77.08 -23.25 51.93 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.634 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.645 ' O ' HG12 ' C' ' 92' ' ' VAL . 1.9 mmt85 -67.99 -32.51 72.96 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -71.29 -48.14 52.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.026 179.676 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.541 ' O ' ' HG ' ' C' ' 95' ' ' LEU . 38.7 tt0 -63.3 -31.77 73.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.583 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.645 HG12 ' O ' ' C' ' 89' ' ' ARG . 1.1 p -77.29 -32.7 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.263 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 43.9 mt-10 -70.95 -26.26 63.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.79 18.14 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.173 178.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' C' ' 91' ' ' GLN . 75.5 mt -57.91 -32.77 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.423 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.439 ' O ' ' HG2' ' C' ' 100' ' ' GLN . 16.9 tt0 -69.68 -44.84 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.623 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.472 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.61 -31.3 74.51 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.748 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.623 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 0.5 OUTLIER -74.72 -44.94 47.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.692 0.282 . . . . 0.0 111.509 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' C' ' 96' ' ' GLN . 13.5 p -71.34 -30.51 40.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.453 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.472 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.2 pt20 -71.64 -42.2 67.89 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.157 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.623 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 10.5 p-80 -77.48 -19.03 56.54 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.902 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.746 HD11 ' HG3' ' A' ' 23' ' ' GLN . 1.5 mp -73.89 -39.45 63.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.532 ' HG3' HD21 ' B' ' 62' ' ' LEU . 38.2 tt0 -66.62 -41.46 88.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.03 71.72 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.421 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.739 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.33 -39.07 93.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.455 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.756 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 3.5 m-85 -58.58 -20.28 45.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.4 t -54.6 -25.67 27.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.212 0.529 . . . . 0.0 110.245 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' C' ' 111' ' ' LYS . 60.4 mm-40 -105.54 -22.82 12.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.085 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.739 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 25.8 m-85 -93.75 -17.83 22.73 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.756 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 74.2 mttt -68.01 -28.54 67.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.021 0.439 . . . . 0.0 110.619 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.05 26.52 8.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.223 0.535 . . . . 0.0 110.327 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' C' ' 109' ' ' TYR . 4.6 t -87.09 -42.66 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.214 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.542 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 7.4 tt0 -99.95 104.77 16.42 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 122.043 0.925 . . . . 0.0 111.342 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.42 ' CD2' ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.465 0 CA-C-N 112.964 -1.926 . . . . 0.0 111.034 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.701 HG22 HG11 ' B' ' 45' ' ' VAL . 82.7 t . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -66.68 -37.52 84.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.785 0.326 . . . . 0.0 110.521 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.716 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 41.1 m -63.32 -26.35 68.72 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.834 0.826 . . . . 0.0 109.154 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 12' ' ' VAL . 62.5 tp -74.21 -39.87 62.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.255 178.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -55.86 -44.4 78.03 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.716 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -63.8 -42.15 97.76 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.757 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.7 tt0 -63.22 -34.8 78.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.989 0.423 . . . . 0.0 110.738 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 8' ' ' LEU . 54.5 t -70.07 -40.63 78.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.577 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 32.5 tt0 -63.3 -32.02 73.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.49 -61.42 2.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.549 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.7 mm? -60.27 -31.41 70.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.485 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.547 ' HA ' HG12 ' A' ' 19' ' ' VAL . 14.4 pt20 -74.16 -28.61 61.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -67.0 -33.55 84.16 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.72 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.9 mm100 -71.09 -50.5 33.1 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.334 -0.433 . . . . 0.0 111.102 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.547 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.4 p -66.8 -33.52 63.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.362 -0.535 . . . . 0.0 111.995 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.58 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -66.11 -43.17 87.99 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.96 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -76.97 -19.71 56.99 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.208 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.771 HD21 ' HG2' ' B' ' 63' ' ' GLN . 24.6 mt -71.01 -42.72 69.22 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' C' ' 102' ' ' LEU . 5.8 tm0? -70.19 -33.49 71.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.89 -62.46 1.73 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.48 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.709 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.85 -42.61 98.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.863 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.74 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -57.0 -25.98 59.45 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.705 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -53.75 -28.59 35.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.267 0.556 . . . . 0.0 110.207 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 54.5 mt-30 -90.75 -50.29 5.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.893 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.709 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 19.5 m-85 -66.58 -17.81 65.02 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -70.86 -20.71 62.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 110.782 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.56 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.25 35.52 3.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.592 0.71 . . . . 0.0 109.495 178.333 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 29' ' ' TYR . 15.5 t -98.65 -35.64 5.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.805 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.549 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 40.3 tt0 -88.19 89.76 8.12 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 122.861 1.315 . . . . 0.0 110.934 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.56 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.995 0 CA-C-N 111.983 -2.371 . . . . 0.0 109.068 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.701 HG11 HG22 ' A' ' 5' ' ' VAL . 83.7 t . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.678 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.34 -38.38 87.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.667 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.0 m -63.8 -23.91 67.55 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.803 0.811 . . . . 0.0 109.548 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.795 ' O ' HG23 ' B' ' 52' ' ' VAL . 65.0 tp -76.04 -39.35 55.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.678 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -56.01 -44.2 78.45 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -64.21 -42.88 96.41 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.565 179.575 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.0 tt0 -62.04 -35.08 77.53 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.034 0.445 . . . . 0.0 110.787 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.795 HG23 ' O ' ' B' ' 48' ' ' LEU . 57.9 t -70.44 -40.11 77.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.607 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 32.9 tt0 -63.39 -32.05 73.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.8 0.809 . . . . 0.0 109.006 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.53 -61.19 2.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.588 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' B' ' 55' ' ' LEU . 2.6 mm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.353 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.532 ' HA ' HG12 ' B' ' 59' ' ' VAL . 14.1 pt20 -73.94 -28.78 61.68 Favored 'General case' 0 C--O 1.222 -0.395 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.577 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -67.25 -33.25 82.14 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 119.909 -1.138 . . . . 0.0 110.506 178.256 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.723 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.8 mm-40 -71.42 -49.66 39.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.547 -0.326 . . . . 0.0 111.263 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.8 p -67.56 -33.06 59.85 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.959 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -66.06 -44.36 84.78 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.899 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -76.01 -19.93 58.25 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.408 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 23.0 mt -71.28 -42.31 68.9 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.771 ' HG2' HD21 ' A' ' 22' ' ' LEU . 5.8 tm0? -69.98 -34.67 73.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.3 -61.94 2.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.459 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.68 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.16 -42.78 99.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.666 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.745 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.67 -26.15 55.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.195 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.9 t -54.1 -27.9 35.89 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.272 0.558 . . . . 0.0 110.325 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 55.8 mt-30 -90.87 -51.0 5.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.592 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.68 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 17.4 m-85 -65.72 -17.83 64.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -71.41 -20.64 62.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.979 0.419 . . . . 0.0 110.756 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.556 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -107.17 36.07 2.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.135 0.969 . . . . 0.0 109.181 178.074 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.495 HG23 ' HA ' ' B' ' 69' ' ' TYR . 15.6 t -99.56 -35.01 4.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.72 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 46.5 tt0 -88.85 89.12 7.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 122.869 1.319 . . . . 0.0 111.029 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.556 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.958 0 CA-C-N 111.713 -2.494 . . . . 0.0 109.256 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.668 HG22 HG11 ' A' ' 5' ' ' VAL . 89.5 t . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.609 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -66.81 -38.35 86.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.401 . . . . 0.0 110.166 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 20.9 m -62.78 -26.31 68.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.883 0.849 . . . . 0.0 109.287 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.691 ' O ' HG12 ' C' ' 92' ' ' VAL . 63.5 tp -73.09 -42.1 63.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.004 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.675 HH11 ' HB3' ' C' ' 89' ' ' ARG . 0.0 OUTLIER -55.82 -43.82 77.31 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.952 0.342 . . . . 0.0 110.637 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -63.48 -41.74 98.57 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.031 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -63.0 -36.77 84.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.953 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.691 HG12 ' O ' ' C' ' 88' ' ' LEU . 0.2 OUTLIER -74.8 -31.29 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.398 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.581 -179.48 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.535 ' O ' ' HG2' ' C' ' 96' ' ' GLN . 36.7 tt0 -65.34 -33.49 76.09 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.51 -58.85 4.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.657 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.3 mm? -60.97 -31.08 70.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.07 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' C' ' 99' ' ' VAL . 14.5 pt20 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.588 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -66.63 -34.11 86.51 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.157 -1.02 . . . . 0.0 110.619 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.5 mm-40 -70.62 -49.43 47.65 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.367 -0.416 . . . . 0.0 111.089 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.7 p -68.08 -32.74 57.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 C-N-CA 120.342 -0.543 . . . . 0.0 112.194 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.86 -43.21 84.2 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.681 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -76.87 -19.69 57.17 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.013 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 23.6 mt -71.55 -41.95 68.45 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.7 ' HG2' HD21 ' B' ' 62' ' ' LEU . 6.3 tm0? -70.69 -34.21 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.39 -62.4 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.472 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.46 -42.49 96.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.664 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.705 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -56.27 -28.26 58.02 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.705 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.8 t -51.19 -29.93 15.49 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.133 0.492 . . . . 0.0 110.314 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.549 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 52.7 mt-30 -89.82 -51.33 5.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.047 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 19.3 m-85 -66.34 -17.27 64.67 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -177.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.47 -19.37 62.22 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.984 0.421 . . . . 0.0 110.875 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.491 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -109.08 35.7 3.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.812 0.815 . . . . 0.0 109.29 177.677 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.523 HG23 ' HA ' ' C' ' 109' ' ' TYR . 16.2 t -98.28 -36.08 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.835 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 43.1 tt0 -87.32 89.51 8.02 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.958 1.361 . . . . 0.0 111.039 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.491 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.933 0 CA-C-N 112.071 -2.331 . . . . 0.0 109.202 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.483 HG22 HG11 ' B' ' 45' ' ' VAL . 96.7 t . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.688 0.28 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.81 -33.46 75.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.112 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.4 m -66.95 -28.71 68.51 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.645 0.735 . . . . 0.0 109.792 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 70.0 tp -73.28 -22.34 60.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.09 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 12' ' ' VAL . 25.8 mmm-85 -69.13 -23.59 63.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.3 OUTLIER -75.34 -40.2 58.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -72.07 -29.29 63.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.841 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.727 HG22 ' HA ' ' A' ' 9' ' ' ARG . 27.6 m -76.05 -38.71 35.6 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.296 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 95.7 mt-10 -70.06 -28.84 65.77 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.65 -60.85 2.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.015 177.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.0 mm? -58.3 -39.43 79.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 17.0 pt20 -67.13 -28.1 67.86 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.738 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.664 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -66.66 -33.42 84.36 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.74 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 82.3 mt-30 -72.05 -40.42 68.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.718 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' LEU . 2.6 t -67.65 -39.9 83.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.963 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.664 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.2 pt20 -62.18 -42.18 99.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.926 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 5.9 p-80 -81.66 -16.79 50.24 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.44 -0.904 . . . . 0.0 111.56 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.74 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -74.01 -43.6 57.43 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.576 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.7 tm0? -68.07 -36.22 79.49 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.64 70.88 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.159 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.33 -43.91 95.99 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.581 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.649 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 1.8 m-85 -52.28 -30.17 26.68 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.489 0.493 . . . . 0.0 111.953 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.5 t -50.69 -31.92 17.81 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.984 0.421 . . . . 0.0 111.142 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.442 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 97.1 mm-40 -89.57 -44.62 9.96 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.8 m-85 -65.21 -20.02 66.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.867 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.3 -26.11 60.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.526 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.23 32.39 4.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.012 0.91 . . . . 0.0 109.453 178.013 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.735 HG11 HG12 ' B' ' 72' ' ' VAL . 65.7 t -128.13 -24.48 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.55 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.855 ' HG3' ' H ' ' A' ' 34' ' ' LEU . 3.5 pt-20 -65.18 -63.8 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.718 0.77 . . . . 0.0 112.361 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.855 ' H ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 113.53 -1.668 . . . . 0.0 115.107 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.483 HG11 HG22 ' A' ' 5' ' ' VAL . 96.4 t . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.773 0.321 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.521 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.1 -33.71 76.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.327 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.9 m -67.17 -28.07 67.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.688 0.756 . . . . 0.0 109.594 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 tp -73.15 -23.03 60.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.101 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.737 ' HA ' HG22 ' B' ' 52' ' ' VAL . 24.1 mmm-85 -69.07 -23.16 64.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.5 OUTLIER -74.99 -40.53 60.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.596 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -72.01 -29.12 63.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.872 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.737 HG22 ' HA ' ' B' ' 49' ' ' ARG . 27.2 m -76.4 -38.59 32.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.206 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 92.6 mt-10 -70.34 -28.06 64.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.79 -60.72 2.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.196 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.584 HD12 HG11 ' C' ' 99' ' ' VAL . 2.1 mm? -58.26 -39.59 79.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.005 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.7 pt20 -66.92 -28.45 68.31 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.398 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -66.15 -33.65 85.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.713 178.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 82.4 mt-30 -71.78 -40.37 69.3 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.497 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' O ' ' B' ' 55' ' ' LEU . 2.5 t -67.99 -39.84 82.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.064 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.3 pt20 -61.53 -42.48 98.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.83 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 5.9 p-80 -81.51 -17.77 47.42 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.447 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 6.5 mt -72.73 -43.7 62.64 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -68.36 -36.54 79.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.99 -50.63 70.31 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.589 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.737 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.36 -43.83 96.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.394 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.598 ' HA ' ' HD2' ' B' ' 69' ' ' TYR . 1.5 m-85 -51.48 -30.67 20.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.692 0.62 . . . . 0.0 111.854 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 40.6 t -49.82 -33.47 16.81 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.837 0.351 . . . . 0.0 111.106 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' B' ' 71' ' ' LYS . 97.4 mm-40 -88.68 -44.4 10.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.492 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.737 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 46.1 m-85 -64.86 -20.5 66.45 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.771 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -57.47 -27.21 62.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.234 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -105.01 31.97 4.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.083 0.944 . . . . 0.0 109.351 178.34 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.735 HG12 HG11 ' A' ' 32' ' ' VAL . 64.6 t -127.83 -24.8 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.257 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.871 ' HG3' ' H ' ' B' ' 74' ' ' LEU . 3.4 pt-20 -64.44 -64.53 0.86 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.663 0.744 . . . . 0.0 112.191 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.871 ' H ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.812 0 C-N-CA 125.987 1.715 . . . . 0.0 115.271 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.453 HG11 HG22 ' B' ' 45' ' ' VAL . 85.2 t . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.646 0.26 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.76 -33.05 75.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.73 0.3 . . . . 0.0 111.129 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.7 m -66.86 -29.05 68.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.652 0.739 . . . . 0.0 109.489 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.438 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 70.2 tp -72.7 -22.77 60.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.86 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 31.2 mmm-85 -66.32 -27.46 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.3 OUTLIER -73.02 -42.16 63.48 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.905 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.83 -27.37 63.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.662 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 0.8 OUTLIER -76.16 -42.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.314 -178.374 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.578 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 94.2 mt-10 -70.97 -27.16 63.53 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.76 -61.08 2.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.257 -1.338 . . . . 0.0 110.079 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.557 ' O ' HG12 ' C' ' 99' ' ' VAL . 1.6 mm? -58.09 -37.97 75.52 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.95 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.578 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 16.5 pt20 -69.13 -27.74 65.84 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.611 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.672 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -66.63 -33.44 84.47 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 178.161 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.45 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 83.5 mt-30 -72.52 -41.93 65.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.403 -0.399 . . . . 0.0 111.181 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.584 HG11 HD12 ' B' ' 55' ' ' LEU . 0.2 OUTLIER -72.38 -30.14 33.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.828 -179.399 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.672 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.0 pt20 -66.6 -43.33 85.15 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.106 -0.237 . . . . 0.0 110.503 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.45 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 8.3 p-80 -79.9 -16.67 54.88 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 119.939 -0.705 . . . . 0.0 111.433 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.649 ' HG ' ' CE2' ' A' ' 26' ' ' PHE . 1.3 mp -75.2 -42.39 55.72 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.09 -50.67 70.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.673 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.21 -43.88 95.59 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.357 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.584 ' HA ' ' HD2' ' C' ' 109' ' ' TYR . 1.6 m-85 -52.14 -30.42 26.46 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.942 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.9 t -49.94 -33.78 18.6 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.979 0.419 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.414 ' O ' ' HE2' ' C' ' 111' ' ' LYS . 97.1 mm-40 -87.46 -45.85 10.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.728 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 43.5 m-85 -64.28 -20.53 66.13 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.933 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -56.2 -28.0 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -105.23 32.07 4.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.947 0.879 . . . . 0.0 109.758 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.737 HG21 ' HA ' ' A' ' 33' ' ' GLU . 59.8 t -128.04 -23.96 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.2 -1.363 . . . . 0.0 110.479 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.807 ' HG3' ' H ' ' C' ' 114' ' ' LEU . 3.6 pt-20 -66.49 -60.44 2.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.875 0.845 . . . . 0.0 112.879 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.807 ' H ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.843 0 CA-C-N 113.859 -1.519 . . . . 0.0 115.04 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.453 -0.299 0 CA-C-O 120.787 0.327 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.44 -33.25 74.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.084 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.739 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 7.9 t -68.14 -20.8 64.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.673 HD11 HG21 ' B' ' 52' ' ' VAL . 59.2 tp -76.2 -28.14 57.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.152 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.642 ' HE ' HD13 ' C' ' 88' ' ' LEU . 23.6 mmm-85 -62.91 -43.67 98.16 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.739 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.49 -37.09 82.33 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.566 178.806 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' SER . 84.7 mt-30 -63.33 -33.77 76.26 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 121.529 0.68 . . . . 0.0 109.469 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.677 HG21 HD11 ' C' ' 88' ' ' LEU . 54.1 t -72.11 -35.08 52.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.469 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 97.7 mt-10 -66.35 -26.2 67.17 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.387 0.613 . . . . 0.0 109.545 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -69.43 -53.15 20.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.221 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.638 HD11 ' HA ' ' B' ' 56' ' ' GLN . 4.0 mm? -56.52 -35.31 67.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.461 178.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.649 ' HA ' HD11 ' C' ' 95' ' ' LEU . 21.6 tt0 -71.3 -43.43 67.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.152 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.59 -31.83 76.22 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.871 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.579 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 58.9 mt-30 -75.27 -41.92 56.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.829 0.347 . . . . 0.0 111.167 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.4 p -73.95 -27.4 22.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.59 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 17.8 pt20 -74.11 -40.01 62.97 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.571 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.3 p-80 -80.95 -19.9 43.17 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.602 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.724 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.8 mp -79.85 -33.99 39.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.642 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.701 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.4 tm0? -74.46 -30.2 61.77 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.3 -62.68 1.7 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.775 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -58.41 -43.29 88.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.371 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.62 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -53.86 -32.06 51.75 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.074 -179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.5 t -50.51 -33.92 23.3 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.712 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 34.7 mt-30 -82.7 -46.78 12.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.236 0.541 . . . . 0.0 110.981 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.66 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 24.9 m-85 -71.29 -18.86 62.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.098 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' A' ' 30' ' ' LYS . 14.2 tmtt? -72.91 -25.71 61.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.752 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.712 ' HE2' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.73 29.49 6.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.724 0.773 . . . . 0.0 109.347 177.014 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.623 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 8.8 t -95.27 -36.79 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.01 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.55 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 14.1 tt0 -95.2 101.05 12.77 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.744 1.259 . . . . 0.0 111.11 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.55 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.295 -1.781 0 CA-C-N 112.738 -2.028 . . . . 0.0 109.365 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.859 0.362 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.56 -33.1 74.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.75 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 8.2 t -68.81 -20.29 64.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.528 0.68 . . . . 0.0 109.277 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.707 HD11 HG21 ' C' ' 92' ' ' VAL . 59.4 tp -76.0 -28.51 57.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.139 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.671 ' HE ' HD13 ' A' ' 8' ' ' LEU . 23.6 mmm-85 -62.88 -43.76 97.92 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.75 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -67.73 -36.59 80.86 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.649 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 47' ' ' SER . 86.1 mt-30 -63.46 -33.54 75.78 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.547 0.689 . . . . 0.0 109.325 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.673 HG21 HD11 ' A' ' 8' ' ' LEU . 63.1 t -73.05 -34.68 46.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.128 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 96.7 mt-10 -66.17 -25.71 67.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.494 0.664 . . . . 0.0 109.241 178.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.06 -52.91 20.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.679 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.635 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.24 -34.82 68.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.265 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.638 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.5 tt0 -71.48 -43.14 67.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.216 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.419 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -60.6 -32.37 78.1 Favored Glycine 0 C--N 1.319 -0.415 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.592 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.583 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 58.9 mt-30 -74.89 -41.63 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.824 0.345 . . . . 0.0 111.418 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.486 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.1 p -74.14 -26.73 21.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.586 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.419 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 17.2 pt20 -74.46 -40.8 61.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.563 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.583 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.5 p-80 -80.16 -19.89 46.12 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.665 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' C' ' 103' ' ' GLN . 1.8 mp -79.51 -34.16 41.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.23 -0.588 . . . . 0.0 109.644 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.724 ' HG2' HD11 ' A' ' 22' ' ' LEU . 4.8 tm0? -74.34 -30.63 62.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.9 -63.17 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.025 -1.443 . . . . 0.0 109.751 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.641 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -57.24 -43.7 83.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.225 178.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.633 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -53.64 -32.64 52.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.012 -179.613 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.7 t -50.41 -32.58 18.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.855 0.36 . . . . 0.0 110.999 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.753 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 32.3 mt-30 -84.31 -46.65 11.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.171 0.51 . . . . 0.0 110.883 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.641 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 22.8 m-85 -70.88 -19.11 62.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.031 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' B' ' 70' ' ' LYS . 14.0 tmtt? -73.04 -24.78 60.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.981 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -107.53 29.65 7.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.952 0.882 . . . . 0.0 109.45 176.814 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.62 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 8.1 t -95.24 -37.56 7.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.107 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.534 ' C ' ' HG ' ' B' ' 74' ' ' LEU . 14.2 tt0 -95.11 99.94 11.84 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 111.06 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.534 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.297 -1.692 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.826 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 86.2 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.819 0.342 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.569 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.53 -32.31 73.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.772 0.32 . . . . 0.0 111.497 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.735 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 7.9 t -69.27 -20.61 63.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.639 0.733 . . . . 0.0 109.209 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.677 HD11 HG21 ' A' ' 12' ' ' VAL . 59.6 tp -75.78 -27.75 58.12 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.218 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.672 ' HE ' HD13 ' B' ' 48' ' ' LEU . 23.4 mmm-85 -63.37 -43.6 97.19 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.735 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.5 -35.59 77.72 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.46 179.067 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' C' ' 87' ' ' SER . 85.4 mt-30 -64.07 -33.41 75.69 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 109.376 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.707 HG21 HD11 ' B' ' 48' ' ' LEU . 54.8 t -72.54 -35.65 51.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.256 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 96.6 mt-10 -65.24 -27.54 68.73 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -68.34 -53.08 26.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.854 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.649 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.4 -34.84 69.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.294 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.635 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.4 tt0 -71.12 -42.81 68.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.169 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.49 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.03 -31.67 77.46 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.86 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.612 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 57.9 mt-30 -75.41 -41.67 55.5 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.558 -0.378 . . . . 0.0 111.132 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -73.96 -27.15 21.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.488 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.49 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 15.6 pt20 -74.12 -41.68 61.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 121.11 -0.236 . . . . 0.0 110.505 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.612 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.6 p-80 -79.29 -19.98 49.13 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.596 -0.842 . . . . 0.0 110.841 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' A' ' 23' ' ' GLN . 1.8 mp -79.37 -34.68 41.77 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.71 ' HG2' HD11 ' B' ' 62' ' ' LEU . 4.3 tm0? -73.81 -31.3 63.17 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 177.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.48 -63.06 1.41 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.678 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -57.82 -43.68 85.92 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.185 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.63 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -53.48 -32.34 49.72 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.384 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 45.9 t -50.91 -33.95 26.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.164 0.507 . . . . 0.0 110.815 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.739 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 33.7 mt-30 -81.99 -46.95 13.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.178 0.514 . . . . 0.0 110.908 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.648 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 26.4 m-85 -70.68 -18.93 62.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.138 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' C' ' 110' ' ' LYS . 14.3 tmtt? -73.38 -24.92 60.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.905 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.739 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -107.21 28.12 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.791 0.805 . . . . 0.0 109.39 176.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.625 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 7.8 t -94.08 -36.9 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.08 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.489 ' HB2' HG21 ' B' ' 72' ' ' VAL . 9.0 tt0 -96.39 102.42 14.21 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.651 1.215 . . . . 0.0 110.808 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.292 -1.933 0 CA-C-N 112.548 -2.115 . . . . 0.0 110.022 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 58.5 t . . . . . 0 C--O 1.233 0.216 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.727 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.74 -30.4 71.5 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.622 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 44.4 t -63.96 -30.2 71.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.673 0.749 . . . . 0.0 109.293 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.585 ' O ' HG13 ' A' ' 12' ' ' VAL . 59.2 tp -73.32 -25.73 60.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -69.03 -21.57 64.11 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.493 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.622 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.7 mt-30 -75.62 -40.53 56.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -69.23 -26.24 64.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.283 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 8' ' ' LEU . 15.2 m -78.21 -33.84 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.236 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.507 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 62.7 mm-40 -65.52 -34.4 78.16 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.89 6.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.952 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.598 HD11 HG11 ' B' ' 59' ' ' VAL . 41.8 tp -59.06 -39.34 81.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.742 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.546 ' HA ' HG12 ' A' ' 19' ' ' VAL . 18.0 pt20 -70.08 -23.28 63.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.649 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -68.72 -31.17 72.93 Favored Glycine 0 C--O 1.239 0.428 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.935 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.695 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.1 mm100 -73.27 -49.08 29.62 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.441 0.638 . . . . 0.0 110.629 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.588 HG11 HD11 ' C' ' 95' ' ' LEU . 7.7 p -70.02 -26.34 29.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 C-N-CA 120.226 -0.59 . . . . 0.0 112.027 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -71.66 -42.46 67.49 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.142 -0.349 . . . . 0.0 110.376 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.455 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.0 p-80 -76.2 -18.13 59.21 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.613 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 18.6 mt -74.08 -39.86 63.14 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.696 ' HG2' HD21 ' C' ' 102' ' ' LEU . 16.1 tm0? -69.4 -34.23 74.19 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -54.78 -63.62 1.09 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.289 177.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -59.18 -40.47 85.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.681 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -55.16 -30.82 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.112 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -58.17 -31.52 67.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -88.56 -15.56 34.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.154 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.557 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.0 m-85 -99.96 -15.29 18.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.606 0.717 . . . . 0.0 110.543 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HG2' ' OH ' ' C' ' 109' ' ' TYR . 1.4 tmtp? -64.46 -33.22 75.38 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.793 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -101.38 23.77 10.56 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.253 0.549 . . . . 0.0 110.507 179.398 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.465 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 26.5 t -92.75 -26.27 4.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -64.35 -69.61 0.27 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.903 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 59.8 t . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.717 0.294 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.45 -30.29 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.036 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.611 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 47.1 t -63.59 -30.55 71.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.638 0.733 . . . . 0.0 109.101 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.567 ' O ' HG13 ' B' ' 52' ' ' VAL . 57.7 tp -73.84 -25.69 60.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.57 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -69.37 -20.29 63.83 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.8 mt-30 -77.03 -40.1 47.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -69.73 -26.61 64.41 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.985 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.567 HG13 ' O ' ' B' ' 48' ' ' LEU . 17.5 m -77.54 -34.32 20.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.302 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.526 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 62.9 mm-40 -65.12 -34.33 78.13 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.75 -59.34 5.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.865 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.559 HD11 HG21 ' C' ' 99' ' ' VAL . 45.4 tp -58.98 -39.11 80.76 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.961 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.554 ' HA ' HG12 ' B' ' 59' ' ' VAL . 17.4 pt20 -70.2 -23.36 62.93 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.623 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -69.36 -29.42 71.81 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.881 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.715 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.1 mm100 -74.35 -48.21 29.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.365 0.603 . . . . 0.0 110.784 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.598 HG11 HD11 ' A' ' 15' ' ' LEU . 6.9 p -70.75 -26.55 28.34 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.713 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.576 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -71.6 -41.99 68.27 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.361 178.409 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.2 p-80 -76.33 -19.57 58.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.595 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 17.8 mt -72.1 -40.8 67.94 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.627 ' HG2' HD21 ' A' ' 22' ' ' LEU . 17.8 tm0? -69.23 -34.07 74.27 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -54.7 -63.14 1.25 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.254 178.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.571 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.64 -39.87 85.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.579 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.534 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.86 -30.04 60.87 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.17 -179.33 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.6 t -59.6 -29.78 68.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.286 0.565 . . . . 0.0 110.79 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -89.07 -15.81 33.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.365 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.571 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 39.2 m-85 -100.66 -15.81 17.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.647 0.737 . . . . 0.0 110.454 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' OH ' ' A' ' 29' ' ' TYR . 1.3 tmtp? -64.5 -32.51 74.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.7 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -101.61 23.8 10.68 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.731 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.475 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 33.4 t -93.07 -26.54 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -64.3 -68.43 0.35 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.938 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.45 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 62.2 t . . . . . 0 N--CA 1.453 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 110.987 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.776 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.65 -28.43 69.61 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 40.9 t -66.38 -29.66 69.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.596 0.712 . . . . 0.0 109.289 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 62.2 tp -73.66 -24.09 59.94 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.909 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.776 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -68.61 -23.32 64.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.711 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.2 mt-30 -75.87 -41.29 52.66 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -69.09 -23.55 64.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.019 178.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.59 -40.81 28.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.277 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.512 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 55.4 mm-40 -64.55 -33.09 75.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.055 0.931 . . . . 0.0 108.56 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.84 6.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.139 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.588 HD11 HG11 ' A' ' 19' ' ' VAL . 42.0 tp -59.52 -40.61 87.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.773 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.618 ' HA ' HG23 ' C' ' 99' ' ' VAL . 17.9 pt20 -68.02 -24.15 65.08 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.575 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -67.39 -30.95 75.81 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.096 -1.05 . . . . 0.0 110.949 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.687 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 9.6 mm100 -72.54 -46.51 54.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.801 0.334 . . . . 0.0 110.269 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.618 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -66.75 -34.69 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.53 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.85 -41.48 87.29 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.675 -177.589 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.475 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 5.4 p-80 -77.64 -19.81 54.86 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.101 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.696 HD21 ' HG2' ' A' ' 23' ' ' GLN . 18.1 mt -73.45 -40.3 64.3 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' B' ' 62' ' ' LEU . 18.2 tm0? -69.82 -34.17 73.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -54.76 -63.18 1.23 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.059 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.569 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.14 -40.15 84.62 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.853 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.63 -31.43 62.3 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.091 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 33.7 t -57.58 -29.21 64.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.158 0.504 . . . . 0.0 110.632 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -90.81 -15.65 29.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.592 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.569 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 41.1 m-85 -100.78 -16.07 17.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.499 0.666 . . . . 0.0 110.642 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.441 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -67.47 -26.73 66.52 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.972 -179.143 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER -104.38 22.43 14.89 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.176 177.968 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 37.2 t -92.13 -26.3 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -64.28 -68.05 0.38 Allowed 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.905 HD13 ' H ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.651 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 -177.331 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.576 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 91.1 t . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.755 0.312 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.09 -32.43 73.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.841 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.702 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 34.5 m -71.4 -23.11 61.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.857 0.837 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.406 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 62.0 tp -77.89 -22.53 49.62 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.676 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -64.14 -44.13 93.13 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.056 178.227 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.702 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -70.39 -47.22 61.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.269 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -61.64 -39.12 90.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.241 0.543 . . . . 0.0 110.838 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 2.6 t -73.2 -27.38 24.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.958 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 19.1 tt0 -67.31 -33.64 75.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.66 -60.83 2.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.632 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.4 mm? -57.32 -37.21 72.13 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.371 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 11.4 pt20 -72.16 -30.41 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.43 -30.32 77.31 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.756 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 35.8 mt-30 -70.56 -48.36 55.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.896 -0.652 . . . . 0.0 110.669 178.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.93 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 10.5 pt20 -59.79 -43.35 94.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.316 -178.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 5.1 p-80 -79.11 -14.55 59.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.544 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -75.66 -42.43 51.33 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.73 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.1 tm0? -68.77 -38.97 80.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.141 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.05 72.32 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.484 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.59 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.31 -47.15 85.53 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.118 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.44 ' CD2' HD22 ' C' ' 102' ' ' LEU . 5.5 m-85 -50.3 -25.77 4.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 47.7 t -49.64 -30.0 8.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.634 ' HG3' ' OE1' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -107.84 -11.62 15.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' B' ' 70' ' ' LYS . 55.0 m-85 -94.94 -21.87 18.35 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.771 -0.581 . . . . 0.0 109.696 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HA ' ' CE2' ' C' ' 109' ' ' TYR . 22.7 pttp -59.64 -21.15 60.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.746 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -103.97 33.55 3.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.444 178.316 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.691 HG12 HG11 ' C' ' 112' ' ' VAL . 71.1 t -124.91 -24.87 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.963 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.78 ' HG3' HD13 ' A' ' 34' ' ' LEU . 16.9 pt-20 -61.76 -40.77 96.29 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.78 HD13 ' HG3' ' A' ' 33' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.507 -0.679 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -176.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.59 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 99.1 t . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.7 -31.84 72.08 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.819 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 40.5 m -71.47 -23.78 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.678 0.751 . . . . 0.0 109.297 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.401 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 64.4 tp -77.57 -22.29 51.19 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 0.0 OUTLIER -63.94 -44.66 92.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.071 178.045 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.0 OUTLIER -69.93 -47.69 61.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -61.3 -38.55 87.2 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.455 0.645 . . . . 0.0 110.912 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.401 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 2.6 t -74.03 -27.28 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.105 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.471 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 22.0 tt0 -67.3 -33.01 74.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.16 -59.83 3.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.835 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' B' ' 55' ' ' LEU . 3.4 mm? -58.55 -37.25 75.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.706 -1.134 . . . . 0.0 112.105 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.471 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 10.8 pt20 -71.83 -30.09 65.11 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.632 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.401 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -65.44 -31.82 81.51 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.79 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 35.6 mt-30 -69.85 -47.23 63.49 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.928 -0.636 . . . . 0.0 110.727 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.451 HG23 ' HA ' ' B' ' 56' ' ' GLN . 0.9 OUTLIER -63.12 -44.62 99.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.693 -179.319 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 11.0 pt20 -59.26 -42.44 91.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.6 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.443 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -80.31 -15.07 57.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.288 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.3 mt -74.82 -42.16 58.57 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 1.9 tm0? -69.12 -38.82 79.1 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.136 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.71 -48.94 71.85 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.202 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -60.95 -47.49 86.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.099 178.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.425 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.3 m-85 -50.38 -26.15 4.65 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 67' ' ' SER . . . . . 0.453 ' O ' ' HE3' ' B' ' 70' ' ' LYS . 46.7 t -49.55 -30.11 8.0 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.633 ' HG3' ' OE1' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -108.25 -9.34 15.53 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.557 ' HE1' ' HB1' ' B' ' 65' ' ' ALA . 60.6 m-85 -97.27 -21.41 17.27 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.532 ' HA ' ' CE2' ' A' ' 29' ' ' TYR . 22.6 pttp -59.16 -22.05 60.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.668 -178.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -103.5 33.77 3.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.537 0.684 . . . . 0.0 110.584 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.721 HG11 HG12 ' C' ' 112' ' ' VAL . 72.1 t -125.29 -24.27 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.835 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.806 ' HG3' HD13 ' B' ' 74' ' ' LEU . 17.1 pt-20 -61.8 -40.39 95.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.806 HD13 ' HG3' ' B' ' 73' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.605 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 93.2 t . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.14 -31.93 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.734 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.704 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 22.5 m -71.75 -23.87 61.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.811 0.815 . . . . 0.0 109.545 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.41 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 62.9 tp -77.42 -22.32 51.72 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.7 ' HB2' ' O ' ' C' ' 86' ' ' ALA . 0.0 OUTLIER -64.39 -43.24 95.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.252 178.087 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.1 pt20 -71.46 -47.35 56.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.196 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -61.31 -39.07 89.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.217 0.532 . . . . 0.0 111.005 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 2.6 t -73.31 -27.81 24.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.068 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.462 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 22.9 tt0 -66.86 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.37 -59.98 3.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.902 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.6 mm? -58.48 -35.86 72.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.275 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.486 ' O ' ' HG2' ' C' ' 100' ' ' GLN . 11.1 pt20 -73.58 -30.26 62.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.409 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.45 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.23 -29.52 75.07 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 177.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.772 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 35.8 mt-30 -72.27 -49.55 33.96 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.015 -0.593 . . . . 0.0 111.019 178.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.424 HG21 HG22 ' B' ' 59' ' ' VAL . 1.6 p -66.5 -34.61 71.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 10.4 pt20 -64.89 -43.97 91.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.554 -0.459 . . . . 0.0 111.104 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.427 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.8 p-80 -77.94 -15.13 59.24 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.83 -0.748 . . . . 0.0 111.037 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.772 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.1 mt -73.9 -41.62 61.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.2 tm0? -69.95 -37.97 76.0 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.14 74.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.379 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.598 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -61.25 -47.89 83.96 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.799 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.449 ' CD2' HD22 ' B' ' 62' ' ' LEU . 3.0 m-85 -49.6 -26.18 3.39 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 107' ' ' SER . . . . . 0.467 ' O ' ' HE3' ' C' ' 110' ' ' LYS . 36.9 t -49.79 -30.52 9.79 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.629 ' HG3' ' OE1' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -106.87 -11.41 15.74 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.557 ' CE2' ' HA ' ' A' ' 30' ' ' LYS . 53.1 m-85 -94.94 -21.93 18.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.645 178.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.554 ' HA ' ' CE2' ' B' ' 69' ' ' TYR . 22.8 pttp -59.28 -21.19 59.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.003 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.09 33.52 3.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 110.325 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.721 HG12 HG11 ' B' ' 72' ' ' VAL . 70.3 t -125.29 -25.92 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.59 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.633 ' OE1' ' HG3' ' B' ' 68' ' ' GLN . 16.6 pt-20 -59.7 -42.72 93.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.314 -0.954 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -176.028 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.5 t . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.742 0.306 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.825 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -70.74 -20.79 62.6 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.74 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.653 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 32.1 t -67.88 -27.63 66.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.54 HD11 HG11 ' B' ' 52' ' ' VAL . 65.2 tp -74.34 -22.85 59.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.626 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.825 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 mmt85 -69.5 -22.1 63.63 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.653 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.5 mt-30 -73.75 -39.31 64.32 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 9.8 mm100 -69.52 -33.17 72.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.577 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.723 HG22 ' HA ' ' A' ' 9' ' ' ARG . 29.0 m -74.53 -31.61 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.697 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.579 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.2 mt-10 -70.43 -29.73 66.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.48 -53.03 48.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.611 177.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.523 HD11 ' HA ' ' B' ' 56' ' ' GLN . 3.9 mm? -57.71 -37.4 73.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.233 -1.349 . . . . 0.0 111.632 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.647 ' HA ' HG12 ' A' ' 19' ' ' VAL . 19.6 pt20 -76.48 -25.03 53.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.215 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.522 ' HA2' ' OE1' ' A' ' 20' ' ' GLN . . . -69.7 -37.52 76.63 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.801 -1.19 . . . . 0.0 110.701 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.703 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 65.4 mt-30 -72.88 -46.63 51.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.026 -0.587 . . . . 0.0 111.321 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.647 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.8 p -69.23 -32.83 55.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.693 -179.028 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.522 ' OE1' ' HA2' ' A' ' 17' ' ' GLY . 18.2 pt20 -67.55 -41.74 83.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.842 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.3 p-80 -78.61 -19.44 52.68 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.271 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.733 HD21 ' HG2' ' B' ' 63' ' ' GLN . 14.2 mt -71.95 -43.73 64.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' C' ' 102' ' ' LEU . 3.6 tm0? -70.38 -33.34 71.29 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.35 -56.05 26.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.866 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.38 -41.38 98.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.132 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.67 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.96 -26.06 59.02 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.519 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -53.43 -26.64 20.78 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.27 0.557 . . . . 0.0 110.34 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -93.02 -53.66 4.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.589 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 21.7 m-85 -63.13 -20.15 65.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.472 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -67.09 -24.27 65.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.781 0.324 . . . . 0.0 110.756 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.84 34.21 3.97 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.748 0.785 . . . . 0.0 109.708 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.605 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 10.8 t -98.78 -33.6 4.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.942 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.66 88.57 7.16 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 122.707 1.241 . . . . 0.0 111.665 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.97 0 CA-C-N 112.438 -2.165 . . . . 0.0 110.296 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 79.1 t . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 120.924 0.392 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.798 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -70.59 -20.62 62.75 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.641 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 19.3 t -68.42 -26.8 65.72 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.551 HD11 HG11 ' C' ' 92' ' ' VAL . 63.6 tp -74.32 -23.26 59.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.522 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.798 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 9.1 mmt85 -69.26 -22.08 63.86 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.3 mt-30 -74.4 -38.16 63.19 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.475 ' O ' HD23 ' B' ' 55' ' ' LEU . 10.1 mm100 -70.57 -32.94 70.54 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.391 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' B' ' 49' ' ' ARG . 28.0 m -74.73 -31.55 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.662 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.588 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 50.7 mt-10 -70.52 -30.03 66.69 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.25 -53.09 49.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.615 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.46 -37.66 73.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.632 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.643 ' HA ' HG12 ' B' ' 59' ' ' VAL . 19.5 pt20 -76.4 -25.34 54.43 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.368 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.506 ' HA2' ' OE1' ' B' ' 60' ' ' GLN . . . -69.61 -37.43 77.46 Favored Glycine 0 C--O 1.242 0.6 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.663 178.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 69.3 mt-30 -72.53 -47.18 50.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.251 -0.475 . . . . 0.0 111.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' B' ' 56' ' ' GLN . 15.0 p -68.74 -32.57 55.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 C-N-CA 120.305 -0.558 . . . . 0.0 112.012 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.506 ' OE1' ' HA2' ' B' ' 57' ' ' GLY . 18.2 pt20 -68.23 -40.91 81.9 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.965 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.2 p-80 -79.18 -19.14 51.63 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.728 HD21 ' HG2' ' C' ' 103' ' ' GLN . 14.6 mt -72.33 -43.19 64.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.733 ' HG2' HD21 ' A' ' 22' ' ' LEU . 3.4 tm0? -70.85 -33.75 70.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.92 -56.39 22.32 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.913 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.756 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.45 -40.77 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.092 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.689 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -57.46 -26.05 60.63 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.485 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t -53.67 -26.64 23.44 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.166 0.508 . . . . 0.0 110.459 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -92.29 -54.84 3.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.459 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.756 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -62.03 -20.12 63.61 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -67.03 -23.46 65.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.849 -179.288 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 33.14 4.74 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.621 0.724 . . . . 0.0 109.678 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.632 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 16.2 t -97.1 -34.45 4.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.206 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -89.97 89.57 7.78 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 122.549 1.166 . . . . 0.0 111.414 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.424 HD22 ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.292 -1.896 0 CA-C-N 112.486 -2.143 . . . . 0.0 110.393 178.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 69.1 t . . . . . 0 N--CA 1.452 -0.362 0 CA-C-O 120.789 0.328 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.828 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -70.5 -20.82 62.81 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 25.0 t -67.94 -27.35 66.54 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 12' ' ' VAL . 65.8 tp -74.26 -22.8 59.16 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.761 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.828 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 9.0 mmt85 -69.59 -22.48 63.51 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.6 mt-30 -74.26 -37.21 63.82 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.469 ' O ' HD23 ' C' ' 95' ' ' LEU . 10.2 mm100 -71.63 -32.75 68.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.29 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.746 HG22 ' HA ' ' C' ' 89' ' ' ARG . 27.5 m -74.63 -31.83 27.97 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.609 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.552 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 49.5 mt-10 -69.72 -30.72 68.41 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.03 -52.98 52.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.777 -1.102 . . . . 0.0 109.706 177.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.517 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.6 -37.69 73.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.696 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.664 ' HA ' HG12 ' C' ' 99' ' ' VAL . 19.5 pt20 -76.23 -25.15 54.76 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.318 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.513 ' HA2' ' OE1' ' C' ' 100' ' ' GLN . . . -69.69 -37.2 76.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 119.9 -1.143 . . . . 0.0 110.729 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.709 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 68.1 mt-30 -73.34 -46.26 50.28 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.419 . . . . 0.0 111.22 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.664 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.7 p -69.45 -32.47 53.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.667 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.513 ' OE1' ' HA2' ' C' ' 97' ' ' GLY . 17.6 pt20 -67.84 -42.17 81.83 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.866 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.1 p-80 -78.43 -18.88 54.31 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.454 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.729 HD21 ' HG2' ' A' ' 23' ' ' GLN . 14.3 mt -72.4 -43.59 63.69 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 177.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.728 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.0 tm0? -70.12 -34.19 72.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 178.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.63 -55.86 28.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.24 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.742 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.45 -40.8 98.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.829 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.695 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -57.57 -24.43 56.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.728 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 31.5 t -55.46 -26.46 42.4 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 110.391 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -92.78 -52.94 4.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.272 178.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.742 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 22.0 m-85 -63.18 -20.51 65.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 0.1 OUTLIER -66.49 -25.91 66.93 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.837 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.531 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -107.66 35.08 3.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.832 0.825 . . . . 0.0 109.949 178.783 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.566 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 12.6 t -99.42 -35.83 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.166 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.563 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 27.1 tt0 -88.92 90.46 8.42 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 122.681 1.229 . . . . 0.0 111.141 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.563 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.296 -1.746 0 CA-C-N 112.581 -2.1 . . . . 0.0 109.421 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 CA--C 1.52 -0.179 0 N-CA-C 110.861 -0.051 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.82 95.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.89 0.376 . . . . 0.0 111.416 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 23.4 m -63.7 -31.03 72.07 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 122.095 0.95 . . . . 0.0 110.353 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HG21 ' B' ' 52' ' ' VAL . 37.0 tp -75.18 -54.54 6.95 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.81 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.878 ' HB3' HD22 ' C' ' 88' ' ' LEU . 0.0 OUTLIER -58.26 -28.58 65.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 123.44 0.463 . . . . 0.0 112.067 -179.024 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.7 pt20 -70.63 -42.4 70.94 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -65.63 -10.3 34.64 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.948 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.92 HG21 HD11 ' C' ' 88' ' ' LEU . 15.7 t -78.57 -38.57 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-O 120.458 0.17 . . . . 0.0 110.769 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 21.9 pt-20 -73.26 -19.17 61.12 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.9 -49.63 23.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.513 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' B' ' 55' ' ' LEU . 10.4 tp -61.71 -33.58 74.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.351 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.593 ' HA ' HD21 ' C' ' 95' ' ' LEU . 1.9 tp-100 -68.53 -42.32 78.65 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.581 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.65 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.77 -30.04 71.71 Favored Glycine 0 C--O 1.236 0.235 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.513 ' HA ' ' ND1' ' A' ' 21' ' ' HIS . 73.5 mt-30 -73.31 -47.4 42.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.263 0.554 . . . . 0.0 110.834 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.1 p -69.64 -26.41 30.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.337 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 15.4 pt20 -73.6 -39.58 64.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.513 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 9.7 p-80 -80.44 -12.29 59.58 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.02 -0.672 . . . . 0.0 109.783 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.683 HD21 ' HG2' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -76.01 -39.21 56.24 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 176.122 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.929 ' HG2' HD11 ' C' ' 102' ' ' LEU . 69.8 mt-30 -70.74 -31.13 67.85 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.24 -44.17 97.17 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.642 177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.624 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.18 -49.67 76.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.732 178.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.494 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 6.5 m-85 -54.96 -25.71 31.54 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.984 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -51.63 -31.8 26.66 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 110.748 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.422 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 76.0 mt-30 -88.55 -54.58 4.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.371 0.605 . . . . 0.0 110.502 178.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.679 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.4 m-85 -63.74 -19.46 64.97 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 21.0 ptmt -68.91 -30.29 68.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.611 0.243 . . . . 0.0 110.883 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -102.15 28.16 6.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.899 0.857 . . . . 0.0 109.813 178.394 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.679 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 24.4 t -94.03 -44.34 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.577 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 5.6 tt0 -111.6 109.76 19.82 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 122.276 1.036 . . . . 0.0 110.065 177.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.604 0 CA-C-N 113.013 -1.903 . . . . 0.0 109.434 -179.049 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.224 -0.239 0 N-CA-C 111.194 0.072 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -41.04 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 0.0 111.244 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' B' ' 50' ' ' GLN . 35.2 m -63.72 -31.38 72.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.259 1.028 . . . . 0.0 110.241 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.969 HD11 HG21 ' C' ' 92' ' ' VAL . 34.5 tp -75.07 -54.91 6.34 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.827 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.916 ' HB3' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -57.61 -28.96 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.465 0.478 . . . . 0.0 111.969 -178.818 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' B' ' 53' ' ' GLU . 2.6 pt20 -70.43 -42.87 71.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.59 -10.58 36.73 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.629 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.958 HG21 HD11 ' A' ' 8' ' ' LEU . 16.2 t -78.18 -37.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.961 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' B' ' 50' ' ' GLN . 22.9 pt-20 -74.08 -18.69 60.78 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -48.52 27.46 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.184 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.832 HD21 ' HB3' ' C' ' 95' ' ' LEU . 10.8 tp -62.66 -32.86 73.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -69.42 -42.65 74.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.577 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.632 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.99 -30.26 69.66 Favored Glycine 0 CA--C 1.52 0.375 0 N-CA-C 111.124 -0.791 . . . . 0.0 111.124 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.511 ' HA ' ' ND1' ' B' ' 61' ' ' HIS . 73.3 mt-30 -72.62 -48.86 36.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.341 0.591 . . . . 0.0 111.046 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 2.4 p -69.14 -26.2 31.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.254 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 15.1 pt20 -73.59 -39.48 64.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.511 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 9.5 p-80 -80.63 -11.4 59.65 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.813 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.594 HD21 ' HG2' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -76.46 -38.83 54.79 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 176.132 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.683 ' HG2' HD21 ' A' ' 22' ' ' LEU . 70.8 mt-30 -70.76 -31.27 68.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 177.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.56 96.35 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.542 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.82 -49.65 76.63 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.879 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.617 ' HE2' HD13 ' A' ' 22' ' ' LEU . 6.7 m-85 -55.56 -25.37 37.54 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.898 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.2 t -52.3 -31.13 31.52 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 118.045 0.384 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.434 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 76.8 mt-30 -88.56 -54.48 4.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.33 0.585 . . . . 0.0 110.621 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.685 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.9 m-85 -63.66 -20.05 65.39 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.563 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 21.1 ptmt -68.55 -30.5 69.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.645 0.26 . . . . 0.0 110.89 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.642 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.38 26.48 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.644 0.735 . . . . 0.0 110.068 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.685 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 25.0 t -92.47 -44.14 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.953 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 10.0 tt0 -112.28 109.93 19.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.32 1.057 . . . . 0.0 109.787 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.551 HD13 ' HA ' ' B' ' 71' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.628 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.161 -178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 66.4 t . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 110.863 -0.051 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.511 ' O ' ' HG2' ' C' ' 90' ' ' GLN . . . -63.85 -43.31 96.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 110.97 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 40.6 m -62.47 -30.58 71.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.937 0.875 . . . . 0.0 110.649 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.92 HD11 HG21 ' A' ' 12' ' ' VAL . 32.8 tp -76.85 -53.53 7.78 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.778 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.886 ' HB3' HD22 ' B' ' 48' ' ' LEU . 0.0 OUTLIER -57.83 -29.52 65.01 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.528 0.518 . . . . 0.0 111.708 -179.033 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' C' ' 93' ' ' GLU . 2.9 pt20 -69.72 -43.28 72.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 176.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 71.9 mt-30 -64.42 -11.82 37.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.915 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.969 HG21 HD11 ' B' ' 48' ' ' LEU . 17.2 t -77.36 -38.85 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 O-C-N 122.346 -0.221 . . . . 0.0 111.141 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' C' ' 90' ' ' GLN . 21.8 pt-20 -73.51 -17.21 61.24 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -74.86 -49.38 20.7 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.35 177.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.832 ' HB3' HD21 ' B' ' 55' ' ' LEU . 3.3 mt -59.76 -37.1 78.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.617 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -66.07 -40.81 91.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.622 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.618 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -61.38 -30.28 73.81 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.524 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 73.4 mt-30 -73.59 -47.86 37.14 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.751 -0.264 . . . . 0.0 110.578 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.491 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -65.9 -32.31 57.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.389 179.334 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 13.7 pt20 -68.36 -39.73 81.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -178.332 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.524 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 13.0 p-80 -81.43 -10.54 59.49 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.795 178.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.929 HD11 ' HG2' ' A' ' 23' ' ' GLN . 0.8 OUTLIER -81.4 -33.5 32.19 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.245 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.594 ' HG2' HD21 ' B' ' 62' ' ' LEU . 71.5 mt-30 -74.45 -29.52 61.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 175.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -62.99 -44.91 94.72 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.478 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.92 -49.99 75.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.688 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.539 ' CE2' HD13 ' B' ' 62' ' ' LEU . 6.5 m-85 -55.04 -25.73 32.56 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.092 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.6 t -51.69 -30.47 22.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.105 0.411 . . . . 0.0 110.594 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.439 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 77.0 mt-30 -89.66 -54.6 3.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.556 0.693 . . . . 0.0 110.678 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.677 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -63.46 -20.2 65.38 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.985 -1.007 . . . . 0.0 113.56 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.569 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 21.3 ptmt -68.37 -30.03 68.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 111.154 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.99 27.04 6.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.693 0.759 . . . . 0.0 109.924 178.533 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.677 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 24.9 t -92.94 -44.22 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.903 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.642 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 6.2 tt0 -112.31 109.54 19.24 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.164 0.983 . . . . 0.0 109.838 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.653 0 CA-C-N 113.033 -1.894 . . . . 0.0 108.977 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 120.803 0.335 . . . . 0.0 110.437 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.78 -37.38 86.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.894 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.748 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -65.96 -22.9 66.5 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.585 0.707 . . . . 0.0 109.899 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.751 ' O ' HG23 ' A' ' 12' ' ' VAL . 52.7 tp -75.91 -30.57 58.8 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.231 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.542 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mmm-85 -62.88 -39.62 95.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.748 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.48 -37.21 79.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.59 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 7' ' ' SER . 82.7 mt-30 -64.24 -30.0 71.07 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.213 0.53 . . . . 0.0 109.868 178.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 8' ' ' LEU . 83.4 t -72.68 -40.27 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.457 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 13.8 tp10 -63.25 -33.99 76.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 122.159 0.981 . . . . 0.0 108.779 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.01 -61.29 2.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.087 -1.415 . . . . 0.0 111.268 178.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.516 HD21 HG11 ' B' ' 59' ' ' VAL . 2.6 tm? -59.51 -38.87 82.08 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.416 -1.266 . . . . 0.0 111.662 -178.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 11.6 pt20 -70.77 -23.32 62.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.436 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.651 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.36 -27.55 73.54 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.035 -1.078 . . . . 0.0 110.44 177.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 80.1 mm-40 -75.04 -48.12 25.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.086 0.47 . . . . 0.0 110.71 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' GLN . 2.4 p -67.97 -33.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.817 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.651 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 4.4 pt20 -66.32 -43.92 84.85 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.877 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.502 ' N ' ' HG3' ' A' ' 20' ' ' GLN . 7.8 p-80 -76.34 -16.08 59.83 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.747 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.9 mt -73.3 -36.93 66.36 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.535 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.8 tm0? -70.99 -33.98 70.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.41 -51.91 67.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.704 177.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.711 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.58 -38.6 90.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.507 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.429 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -55.7 -30.03 60.41 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.369 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 t -49.22 -27.3 3.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.993 0.425 . . . . 0.0 111.13 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -96.04 -45.61 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 22.4 m-85 -68.42 -21.51 64.66 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 45.9 mtpt -71.21 -28.68 64.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.721 0.295 . . . . 0.0 111.159 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.447 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -100.17 30.31 3.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.665 0.745 . . . . 0.0 109.677 178.592 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.565 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 13.0 t -95.66 -42.56 12.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.952 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.54 ' HB2' HG22 ' C' ' 112' ' ' VAL . 18.9 tt0 -103.44 101.87 11.77 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.086 0.946 . . . . 0.0 111.034 178.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.683 0 CA-C-N 112.905 -1.952 . . . . 0.0 110.291 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.739 0.304 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.535 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -65.72 -37.55 86.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.195 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.734 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 51.1 m -66.25 -22.29 66.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.641 0.734 . . . . 0.0 109.76 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.738 ' O ' HG23 ' B' ' 52' ' ' VAL . 50.6 tp -75.93 -31.12 58.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.321 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.536 ' HE ' HD13 ' A' ' 8' ' ' LEU . 16.7 mmm-85 -62.75 -39.74 95.08 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.734 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -68.0 -37.72 81.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.717 178.657 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' B' ' 47' ' ' SER . 82.3 mt-30 -63.99 -30.21 71.3 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.459 0.647 . . . . 0.0 109.889 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 48' ' ' LEU . 77.6 t -71.72 -41.48 70.71 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.046 179.211 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 15.1 tp10 -62.04 -33.57 74.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.218 1.009 . . . . 0.0 108.93 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.71 -60.67 2.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.465 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.406 HD21 HG21 ' C' ' 99' ' ' VAL . 2.6 tm? -59.99 -38.87 83.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.568 -1.197 . . . . 0.0 111.571 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' B' ' 59' ' ' VAL . 12.2 pt20 -70.27 -24.41 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.384 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.64 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -66.99 -26.7 73.27 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 119.924 -1.131 . . . . 0.0 110.441 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 80.9 mm-40 -75.86 -48.6 20.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.317 0.58 . . . . 0.0 110.72 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' B' ' 56' ' ' GLN . 2.4 p -67.93 -31.69 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.687 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.64 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 3.1 pt20 -67.74 -43.67 79.38 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.785 178.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.526 ' N ' ' HG3' ' B' ' 60' ' ' GLN . 7.7 p-80 -76.47 -14.92 60.01 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 119.51 -0.876 . . . . 0.0 110.657 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.6 mt -74.57 -37.9 62.83 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 176.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.554 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.1 tm0? -70.29 -33.8 71.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 177.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.46 -51.0 71.71 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.787 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.704 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.89 -38.84 92.51 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.572 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.421 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.3 OUTLIER -56.07 -29.55 60.69 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.269 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -50.07 -26.37 4.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.082 0.468 . . . . 0.0 110.841 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -96.34 -46.29 6.46 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.621 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.704 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -68.54 -21.14 64.57 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.439 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 48.0 mtpt -71.63 -27.3 63.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.744 0.307 . . . . 0.0 110.982 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.485 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.66 30.9 4.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.724 0.773 . . . . 0.0 109.649 178.209 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.582 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 12.6 t -96.24 -42.94 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.794 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.498 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 20.3 tt0 -103.32 101.74 11.68 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.13 0.967 . . . . 0.0 111.252 178.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-N 112.863 -1.971 . . . . 0.0 110.257 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 98.6 t . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.737 0.303 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.474 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.73 -37.1 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.94 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.759 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 49.1 m -66.82 -23.18 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.476 0.655 . . . . 0.0 109.653 178.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.529 ' O ' HG12 ' C' ' 92' ' ' VAL . 49.3 tp -73.96 -32.06 63.3 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.851 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.629 ' HA ' HG13 ' C' ' 92' ' ' VAL . 13.3 mmm-85 -63.27 -37.97 89.33 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.759 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.56 -36.74 79.18 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' C' ' 87' ' ' SER . 81.8 mt-30 -64.13 -33.14 75.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.128 177.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.629 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -75.11 -31.89 25.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.942 179.576 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.436 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 15.8 tp10 -64.64 -36.33 83.91 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.35 -59.75 4.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.522 -1.217 . . . . 0.0 111.322 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.528 HD21 HG11 ' A' ' 19' ' ' VAL . 2.5 tm? -58.93 -40.21 83.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.551 -178.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.675 ' HA ' HG23 ' C' ' 99' ' ' VAL . 12.9 pt20 -69.35 -24.3 63.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.483 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.536 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.13 -28.18 73.49 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.356 -1.097 . . . . 0.0 110.356 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.718 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 78.8 mm-40 -74.43 -46.27 41.06 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.414 178.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.675 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.01 -41.69 93.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.421 -0.511 . . . . 0.0 111.169 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.536 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.3 pt20 -61.87 -43.15 99.43 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.031 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.553 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.2 p-80 -78.55 -14.85 59.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.774 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.3 mt -74.21 -37.91 63.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.2 tm0? -71.08 -34.19 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.13 -51.51 69.42 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.396 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.09 -38.14 90.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.804 178.708 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.539 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 1.0 OUTLIER -56.32 -29.67 61.59 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 123.451 0.469 . . . . 0.0 111.016 178.848 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 29.6 t -48.37 -26.94 2.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.107 0.48 . . . . 0.0 111.024 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -96.98 -46.5 6.18 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.909 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 21.5 m-85 -68.48 -20.57 64.61 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.539 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 44.3 mtpt -72.11 -28.1 63.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.606 ' HA ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -101.33 31.51 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.832 0.825 . . . . 0.0 109.84 178.157 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.564 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -96.49 -42.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.956 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.562 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 20.6 tt0 -103.04 100.85 10.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.287 1.042 . . . . 0.0 111.306 178.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 112.794 -2.003 . . . . 0.0 109.847 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.549 HG11 HG22 ' C' ' 85' ' ' VAL . 61.4 t . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.907 0.384 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -68.41 -29.29 67.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.752 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.59 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 49.2 m -70.02 -22.51 63.09 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.949 0.88 . . . . 0.0 109.391 178.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.2 tp -76.8 -21.72 54.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.513 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.655 ' O ' HG12 ' A' ' 12' ' ' VAL . 7.9 mmm180 -67.56 -33.9 75.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -71.7 -47.12 56.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 179.727 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -64.53 -27.75 69.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.281 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -77.64 -36.92 23.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.766 -178.658 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.499 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.7 mt-10 -69.99 -28.6 65.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.29 -50.93 63.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.341 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.434 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.0 tp -60.79 -39.13 87.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.124 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.499 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 12.2 pt20 -71.42 -23.45 61.86 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.325 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.6 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.34 -28.36 73.31 Favored Glycine 0 C--O 1.24 0.521 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.441 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.678 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.3 mm-40 -73.65 -42.77 60.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.98 0.419 . . . . 0.0 110.005 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.554 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 3.4 t -65.94 -42.58 92.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.159 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.6 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.6 pt20 -62.33 -41.44 98.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.539 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.449 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 6.9 p-80 -79.26 -17.38 54.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.806 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.3 mt -71.95 -47.57 51.38 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.718 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 13.2 pt20 -71.36 -22.7 61.86 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -62.21 -51.3 68.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.4 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.01 -41.64 99.63 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.548 177.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.718 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -52.03 -29.13 19.73 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.692 178.866 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.4 t -47.67 -33.47 6.89 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.008 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.87 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 69.6 mt-30 -86.73 -51.51 6.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.457 0.646 . . . . 0.0 110.884 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.666 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.3 m-85 -63.94 -21.31 66.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.29 -0.868 . . . . 0.0 113.167 -177.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' CE2' ' C' ' 109' ' ' TYR . 10.4 mmmm -64.63 -32.2 73.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.963 0.411 . . . . 0.0 110.51 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.87 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -108.52 35.91 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.095 0.474 . . . . 0.0 110.763 179.394 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.666 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 5.9 t -95.66 -43.59 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.575 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.444 ' HB2' HG22 ' C' ' 112' ' ' VAL . 33.7 tt0 -104.52 102.35 11.98 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 122.084 0.945 . . . . 0.0 110.551 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.413 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.462 0 CA-C-N 113.041 -1.89 . . . . 0.0 111.288 -179.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.533 HG11 HG22 ' A' ' 5' ' ' VAL . 60.8 t . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.778 0.323 . . . . 0.0 110.335 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.479 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.53 -29.35 68.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.788 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.613 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.6 m -69.28 -23.97 63.9 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.715 0.769 . . . . 0.0 109.461 178.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.5 tp -76.0 -21.96 56.34 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.642 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.675 ' O ' HG12 ' B' ' 52' ' ' VAL . 8.2 mmm180 -67.07 -33.96 76.64 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -71.68 -47.0 57.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.861 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -64.56 -28.11 69.41 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.062 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.675 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -76.95 -36.82 25.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.953 -178.538 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.519 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 47.8 mt-10 -70.57 -28.1 64.64 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 122.017 0.913 . . . . 0.0 108.551 176.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.22 -51.58 60.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.07 177.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.617 HD11 HG11 ' C' ' 99' ' ' VAL . 25.9 tp -60.19 -40.13 88.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.25 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.519 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 12.7 pt20 -70.68 -23.29 62.46 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.438 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.575 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.43 -29.1 72.96 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.669 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.5 mm100 -73.01 -42.44 63.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.112 0.482 . . . . 0.0 110.062 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.534 ' O ' ' HG2' ' B' ' 63' ' ' GLN . 3.5 t -66.62 -42.11 89.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.344 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.575 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.2 pt20 -62.41 -41.85 98.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.07 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.474 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.76 -17.23 56.13 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.137 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.5 mt -72.98 -46.5 51.93 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.755 ' HA ' ' HB2' ' B' ' 66' ' ' PHE . 12.7 pt20 -71.76 -22.14 61.64 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -62.42 -51.44 67.51 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.625 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.34 -41.68 98.9 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.498 177.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.755 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -51.94 -29.28 19.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.517 179.058 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 41.8 t -47.89 -34.71 9.3 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.862 0.363 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.867 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 66.9 mt-30 -85.45 -50.54 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.2 0.524 . . . . 0.0 110.841 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.689 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 15.9 m-85 -64.89 -20.62 66.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.447 ' HD2' ' CE2' ' A' ' 29' ' ' TYR . 10.2 mmmm -65.05 -32.24 73.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.117 0.484 . . . . 0.0 110.419 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.867 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -108.07 36.74 2.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.6 0.714 . . . . 0.0 110.637 179.08 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.689 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -96.51 -43.2 12.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.549 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.466 ' HB2' HG22 ' A' ' 32' ' ' VAL . 34.4 tt0 -105.11 100.83 10.41 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.031 0.92 . . . . 0.0 110.866 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.421 ' CD2' ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.474 0 CA-C-N 113.404 -1.726 . . . . 0.0 111.29 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.549 HG22 HG11 ' A' ' 5' ' ' VAL . 73.7 t . . . . . 0 CA--C 1.528 0.132 0 CA-C-O 120.754 0.311 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.18 -29.84 68.81 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.832 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.1 m -69.19 -22.76 63.88 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.874 0.845 . . . . 0.0 109.22 178.372 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.619 ' O ' HG22 ' C' ' 92' ' ' VAL . 67.1 tp -76.15 -23.02 54.78 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.713 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.51 ' HA ' ' CG2' ' C' ' 92' ' ' VAL . 8.5 mmm180 -67.51 -31.88 72.31 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.664 0.745 . . . . 0.0 109.032 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -72.51 -45.2 60.51 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.482 -0.781 . . . . 0.0 108.949 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 64.5 tt0 -65.07 -29.31 70.18 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.257 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.619 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.14 -42.18 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.91 179.181 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.1 mt-10 -65.0 -29.52 70.45 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.13 -52.89 52.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.408 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 16' ' ' GLN . 28.4 tp -60.22 -39.93 88.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.325 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.54 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 13.0 pt20 -71.92 -22.29 61.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.408 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.595 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -69.59 -27.83 72.95 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.655 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 11.2 mm100 -74.63 -44.62 49.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.162 0.506 . . . . 0.0 110.413 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.617 HG11 HD11 ' B' ' 55' ' ' LEU . 0.1 OUTLIER -70.74 -31.96 47.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.124 -179.077 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.595 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.8 pt20 -67.04 -42.45 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.707 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.465 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 7.6 p-80 -77.45 -17.53 58.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.234 -0.986 . . . . 0.0 110.592 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 8.4 mt -71.81 -47.06 55.9 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.706 ' HA ' ' HB2' ' C' ' 106' ' ' PHE . 14.3 pt20 -70.99 -22.75 62.14 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -61.68 -51.99 66.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.639 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.31 -41.64 98.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.706 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -51.77 -29.32 18.42 Favored 'General case' 0 C--O 1.214 -0.781 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.411 178.874 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 46.4 t -47.75 -34.67 8.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.831 0.348 . . . . 0.0 111.124 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.86 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 69.4 mt-30 -85.23 -50.99 6.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.51 0.672 . . . . 0.0 110.665 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.668 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 16.1 m-85 -64.5 -21.58 66.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.136 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.488 ' HD2' ' CE2' ' B' ' 69' ' ' TYR . 10.4 mmmm -65.16 -30.25 71.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.442 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.86 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -109.75 36.94 2.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.523 0.678 . . . . 0.0 110.446 179.204 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.668 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.8 t -97.22 -43.72 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.663 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.53 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 35.8 tt0 -104.73 100.66 10.3 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.252 1.025 . . . . 0.0 110.725 179.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.656 HD21 ' HA ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.304 -1.382 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.491 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 74.4 t . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -71.22 -24.81 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.122 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.656 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -73.49 -18.58 61.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.67 0.748 . . . . 0.0 109.618 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.407 HD22 ' HE ' ' B' ' 49' ' ' ARG . 60.0 tp -79.03 -18.81 52.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.729 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -70.79 -44.33 66.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.219 177.856 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.2 pt20 -70.8 -33.91 71.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.007 0.432 . . . . 0.0 109.946 178.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.9 tt0 -69.86 -31.22 68.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.457 0.646 . . . . 0.0 110.391 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.729 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.4 p -79.3 -31.47 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.154 -179.075 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 46.3 mt-10 -76.06 -20.47 57.72 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.06 -51.62 30.51 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.284 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.0 tp -63.16 -30.48 71.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.972 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.567 ' HA ' HD21 ' C' ' 95' ' ' LEU . 13.0 tt0 -64.4 -40.49 95.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.53 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.645 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -63.44 -27.39 70.75 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.424 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.6 mm100 -71.51 -42.34 68.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.947 0.403 . . . . 0.0 110.047 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.457 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 2.4 t -70.88 -37.61 69.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.775 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.645 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 15.3 pt20 -64.37 -40.99 96.93 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.818 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.537 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -80.12 -17.48 52.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.316 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.731 HD21 ' HG2' ' B' ' 63' ' ' GLN . 7.0 mt -71.43 -38.44 71.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' C' ' 102' ' ' LEU . 34.4 mt-30 -73.78 -27.5 61.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.7 -56.79 17.42 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.099 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.646 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.33 -43.89 97.76 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.142 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -53.42 -26.09 18.47 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.975 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -53.98 -36.89 63.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 111.446 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.614 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 24.7 pt20 -87.45 -36.48 17.67 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.103 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.741 ' OH ' ' HD2' ' B' ' 70' ' ' LYS . 26.5 m-85 -73.66 -20.41 60.57 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.439 0.638 . . . . 0.0 110.906 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.697 ' HD2' ' OH ' ' C' ' 109' ' ' TYR . 35.2 tptt -64.56 -40.32 95.35 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.172 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.629 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -95.38 31.48 1.96 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.684 0.754 . . . . 0.0 110.524 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.549 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 9.4 t -95.45 -41.27 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.062 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.556 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 16.8 tt0 -102.62 103.45 13.74 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 122.177 0.989 . . . . 0.0 110.464 178.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.408 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.632 0 CA-C-N 112.942 -1.935 . . . . 0.0 110.292 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.483 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 82.2 t . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.647 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -71.29 -23.92 62.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.025 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.9 m -74.52 -18.56 60.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.6 0.714 . . . . 0.0 109.74 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.493 HD22 ' HE ' ' C' ' 89' ' ' ARG . 61.3 tp -79.36 -18.27 52.79 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.713 ' O ' HG12 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -70.75 -44.27 67.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.212 177.773 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.4 pt20 -70.91 -34.84 71.95 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 40.1 tt0 -68.88 -30.79 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.565 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.713 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.5 p -79.67 -32.23 14.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.233 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 46.1 mt-10 -75.54 -20.17 58.86 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.13 -51.88 27.96 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.156 177.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.582 HD21 ' HB3' ' C' ' 95' ' ' LEU . 23.0 tp -63.09 -30.29 71.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.989 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -64.0 -39.83 94.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.572 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.637 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -64.39 -26.89 71.0 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.733 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.664 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.2 mm100 -72.03 -42.7 66.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.062 0.458 . . . . 0.0 110.0 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.4 t -69.97 -37.96 74.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.782 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.637 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -64.53 -41.76 96.17 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.013 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.53 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.9 p-80 -78.9 -17.32 55.74 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.328 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.723 HD21 ' HG2' ' C' ' 103' ' ' GLN . 7.0 mt -71.88 -38.43 70.02 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' A' ' 22' ' ' LEU . 34.9 mt-30 -73.98 -26.51 60.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -61.07 -55.96 26.5 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.09 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.82 -44.98 94.72 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.042 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -52.46 -25.94 11.46 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.893 179.211 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 28.2 t -54.61 -35.62 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.748 0.249 . . . . 0.0 111.44 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' B' ' 65' ' ' ALA . 24.0 pt20 -88.74 -36.4 16.15 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.039 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.742 ' OH ' ' HD2' ' C' ' 110' ' ' LYS . 27.0 m-85 -73.79 -19.96 60.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.304 0.573 . . . . 0.0 110.761 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.741 ' HD2' ' OH ' ' A' ' 29' ' ' TYR . 32.8 tptt -64.55 -41.23 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.933 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.608 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -94.53 31.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.433 0.635 . . . . 0.0 110.775 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 9.3 t -95.17 -41.68 12.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.931 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.629 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 15.1 tt0 -102.46 103.41 13.79 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 122.24 1.019 . . . . 0.0 110.658 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.421 ' CD2' ' N ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.615 0 CA-C-N 112.811 -1.995 . . . . 0.0 110.114 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.493 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 84.9 t . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.62 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -71.84 -24.01 61.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.265 178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 71.1 m -74.9 -18.57 60.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.743 0.783 . . . . 0.0 109.25 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.727 ' O ' HG22 ' C' ' 92' ' ' VAL . 57.0 tp -77.63 -19.3 55.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.62 ' HB2' ' O ' ' C' ' 86' ' ' ALA . 0.2 OUTLIER -71.32 -42.71 68.24 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.649 178.272 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 pt20 -70.95 -33.52 70.55 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 38.8 tt0 -68.82 -33.49 73.92 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.238 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.727 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.82 -38.52 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.913 178.243 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 42.0 mt-10 -68.49 -21.56 64.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.96 -52.54 23.55 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.208 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.582 ' HB3' HD21 ' B' ' 55' ' ' LEU . 0.3 OUTLIER -60.66 -33.52 72.94 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.944 178.128 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -62.66 -40.38 96.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.899 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.543 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -64.87 -27.19 71.81 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.481 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.2 mm100 -71.58 -42.77 67.38 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 178.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.476 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 2.5 t -70.73 -37.17 67.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.543 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.3 pt20 -65.25 -40.74 94.39 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.616 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.568 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.6 p-80 -80.42 -17.5 51.6 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.296 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.689 HD21 ' HG2' ' A' ' 23' ' ' GLN . 7.2 mt -71.13 -38.53 72.28 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.723 ' HG2' HD21 ' B' ' 62' ' ' LEU . 34.4 mt-30 -73.87 -27.21 60.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.51 -56.96 15.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.299 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.638 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.16 -44.45 96.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.155 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -52.92 -26.88 16.36 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.022 179.461 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 34.4 t -53.14 -37.84 62.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.684 0.278 . . . . 0.0 111.194 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' C' ' 105' ' ' ALA . 25.1 pt20 -87.0 -35.9 18.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.368 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.697 ' OH ' ' HD2' ' A' ' 30' ' ' LYS . 28.7 m-85 -74.21 -19.93 60.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.361 0.6 . . . . 0.0 110.85 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.742 ' HD2' ' OH ' ' B' ' 69' ' ' TYR . 32.0 tptt -64.67 -40.8 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.994 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.608 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -95.06 31.71 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.481 0.658 . . . . 0.0 110.753 179.08 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.535 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 10.9 t -95.97 -41.38 11.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.954 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.608 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 15.7 tt0 -102.52 101.69 11.89 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-O 122.459 1.124 . . . . 0.0 111.221 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.551 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.3 -1.559 0 CA-C-N 112.651 -2.068 . . . . 0.0 109.723 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 HG11 ' B' ' 45' ' ' VAL . 90.1 t . . . . . 0 C--O 1.234 0.238 0 CA-C-O 120.737 0.303 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.636 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.0 -24.84 64.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.289 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 70.7 m -69.66 -26.18 64.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.0 tp -73.59 -23.55 59.95 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.053 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 48.4 mmm-85 -63.45 -23.68 67.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.253 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.0 mt-30 -76.34 -43.21 42.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.522 -179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 52.0 tt0 -70.03 -29.29 66.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.454 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.9 t -74.6 -36.37 40.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.077 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -66.36 -32.12 73.31 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -64.98 -56.73 11.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.283 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 mp -57.7 -39.08 76.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.034 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -70.67 -31.33 68.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.1 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -72.72 -31.14 62.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 119.933 -1.127 . . . . 0.0 111.494 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 14' ' ' ALA . 22.6 mm100 -76.37 -35.52 58.63 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 120.806 0.336 . . . . 0.0 110.575 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.7 t -77.16 -32.03 18.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.729 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.589 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -67.98 -40.12 83.17 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.487 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.526 ' CE1' HD12 ' A' ' 22' ' ' LEU . 6.8 p-80 -80.44 -25.6 38.86 Favored 'General case' 0 N--CA 1.46 0.049 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.928 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.756 HD11 ' HG3' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -72.87 -39.73 66.22 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.863 178.475 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.694 ' HG3' HD21 ' C' ' 102' ' ' LEU . 26.6 tt0 -70.71 -36.86 73.44 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.87 -56.61 19.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.967 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.35 -48.21 82.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.77 179.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.775 ' HD2' HD13 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.54 -24.84 22.53 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.064 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.2 t -49.61 -32.2 12.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.64 0.257 . . . . 0.0 111.04 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.429 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 12.9 mm100 -96.3 -45.63 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.081 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.8 m-85 -66.47 -20.08 65.95 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -73.24 -4.4 32.82 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.908 0.385 . . . . 0.0 110.868 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.609 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -127.76 36.06 4.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.983 0.897 . . . . 0.0 108.73 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.569 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 12.8 t -100.58 -34.63 4.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.127 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -85.62 81.64 8.57 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 122.969 1.366 . . . . 0.0 111.417 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.609 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.292 -1.922 0 CA-C-N 111.95 -2.387 . . . . 0.0 109.539 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.416 HG11 HG22 ' A' ' 5' ' ' VAL . 97.7 t . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.924 0.393 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -68.84 -25.58 64.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.244 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 73.4 m -69.01 -26.22 64.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 55.7 tp -73.1 -23.79 60.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.066 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.654 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 47.8 mmm-85 -63.81 -21.85 66.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.973 0.415 . . . . 0.0 110.215 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.3 mt-30 -77.94 -43.68 29.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.287 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 52.0 tt0 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.622 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 26.7 t -74.85 -37.79 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 88.8 tt0 -65.37 -31.79 73.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' B' ' 58' ' ' GLN . . . -65.35 -56.58 11.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.442 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 59' ' ' VAL . 4.7 mp -57.68 -39.23 76.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.93 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.459 ' HB3' HD21 ' A' ' 15' ' ' LEU . 19.8 pt20 -70.35 -31.95 69.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.087 -179.067 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.582 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -71.98 -30.89 64.98 Favored Glycine 0 C--O 1.238 0.396 0 C-N-CA 120.08 -1.057 . . . . 0.0 111.373 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' B' ' 54' ' ' ALA . 22.5 mm100 -76.58 -36.49 57.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.795 0.331 . . . . 0.0 110.528 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.9 t -76.28 -31.29 20.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 122.256 -0.278 . . . . 0.0 110.711 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -69.02 -40.51 78.62 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.279 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.548 ' CE1' HD12 ' B' ' 62' ' ' LEU . 6.8 p-80 -80.18 -24.97 39.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 119.856 -0.738 . . . . 0.0 111.061 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.673 HD11 ' HG3' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -74.03 -39.5 63.53 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.584 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.756 ' HG3' HD11 ' A' ' 22' ' ' LEU . 23.3 tt0 -69.93 -38.72 76.29 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.57 30.6 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.122 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.722 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.51 -48.03 82.9 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.797 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.692 ' HD2' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.65 -24.39 21.45 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.286 -179.615 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -49.96 -31.88 13.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.772 0.32 . . . . 0.0 110.999 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' B' ' 71' ' ' LYS . 12.8 mm100 -96.83 -44.86 6.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 111.096 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.722 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 14.4 m-85 -67.12 -19.69 65.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -73.57 -4.07 31.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.023 0.439 . . . . 0.0 110.786 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.619 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -127.98 35.89 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.782 0.801 . . . . 0.0 109.012 177.557 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.56 HG23 ' HA ' ' B' ' 69' ' ' TYR . 11.8 t -100.33 -34.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.101 -179.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -84.79 80.89 9.11 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 123.11 1.434 . . . . 0.0 111.402 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.619 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.292 -1.893 0 CA-C-N 111.978 -2.374 . . . . 0.0 109.926 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 92.1 t . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 120.84 0.352 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.657 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.68 -25.02 64.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.283 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 73.4 m -69.67 -25.75 64.05 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 54.9 tp -73.77 -23.6 59.74 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.984 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.657 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 48.3 mmm-85 -64.21 -21.7 66.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.194 178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 mt-30 -78.45 -43.47 27.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.027 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 51.8 tt0 -69.42 -29.91 67.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.728 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 25.3 t -74.71 -36.14 39.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.819 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.03 -31.27 72.06 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' C' ' 98' ' ' GLN . . . -66.02 -56.42 11.69 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.249 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.604 ' O ' HG23 ' C' ' 99' ' ' VAL . 7.3 mt -57.05 -40.33 76.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.703 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' B' ' 55' ' ' LEU . 20.0 pt20 -70.06 -32.32 70.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.397 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.592 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -71.62 -31.66 65.09 Favored Glycine 0 C--O 1.239 0.451 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.268 178.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' C' ' 94' ' ' ALA . 22.4 mm100 -76.2 -34.91 59.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.674 0.273 . . . . 0.0 110.706 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.604 HG23 ' O ' ' C' ' 95' ' ' LEU . 60.1 t -77.52 -31.46 17.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.697 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -68.71 -38.72 80.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.324 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.59 ' CE1' HD23 ' C' ' 102' ' ' LEU . 6.3 p-80 -81.77 -26.41 34.47 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.604 -0.839 . . . . 0.0 111.097 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.775 HD13 ' HD2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.54 -47.09 70.88 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.712 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.673 ' HG3' HD11 ' B' ' 62' ' ' LEU . 24.2 tt0 -67.51 -38.38 84.21 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.31 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.64 -55.96 25.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.002 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.729 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.01 -47.78 84.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.993 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.646 ' HD2' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -54.93 -24.01 21.66 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.968 -179.432 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.2 t -50.44 -31.04 14.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.638 0.256 . . . . 0.0 110.841 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' C' ' 111' ' ' LYS . 12.8 mm100 -97.58 -46.0 6.19 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.002 178.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.729 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 15.5 m-85 -65.98 -19.98 66.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -72.75 -5.15 35.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.024 0.44 . . . . 0.0 110.856 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.542 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -126.8 35.39 4.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.97 0.891 . . . . 0.0 108.908 177.636 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.594 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -99.4 -34.81 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.236 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -85.19 81.43 8.83 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 123.081 1.42 . . . . 0.0 111.427 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.542 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.29 -2.005 0 CA-C-N 112.029 -2.35 . . . . 0.0 109.62 179.507 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.677 HG22 HG11 ' B' ' 45' ' ' VAL . 45.3 t . . . . . 0 N--CA 1.454 -0.25 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.663 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.8 -27.0 62.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.393 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 66.2 m -71.0 -17.49 62.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.813 0.816 . . . . 0.0 109.247 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.6 tp -78.21 -21.83 49.46 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.485 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.663 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -69.62 -16.65 63.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.46 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.472 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 9.0 mm-40 -77.87 -40.02 41.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.774 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.492 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 35.5 tp60 -73.24 -25.18 60.62 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.014 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.87 -45.92 54.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.8 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -67.53 -26.91 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -63.07 -54.29 40.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.36 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' B' ' 56' ' ' GLN . 13.1 tp -60.86 -32.96 72.37 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.647 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.606 ' HA ' HD11 ' C' ' 95' ' ' LEU . 10.3 tt0 -63.6 -36.42 83.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.33 178.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.21 -31.43 76.94 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.803 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.638 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 71.0 mt-30 -73.98 -47.54 36.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.093 0.473 . . . . 0.0 111.213 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.6 p -66.48 -36.16 76.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -65.78 -44.58 85.35 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.869 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.508 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -75.36 -13.76 60.43 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.368 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -73.58 -34.69 65.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.29 -35.41 77.8 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.41 -50.69 72.18 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.531 178.056 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.79 -42.46 99.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.056 178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.54 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 6.6 m-85 -56.27 -27.28 54.71 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.71 179.408 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t -54.63 -27.13 37.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.164 0.507 . . . . 0.0 110.606 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 87.4 mm-40 -94.68 -37.6 11.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.607 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 37.7 m-85 -77.98 -18.81 55.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 0.0 111.481 -179.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 4.2 tmtt? -58.04 -49.88 75.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.42 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.729 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER -88.77 39.46 0.92 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.206 1.003 . . . . 0.0 110.501 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.57 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 51.4 t -125.1 -10.55 5.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.673 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.582 ' HA ' HG21 ' C' ' 112' ' ' VAL . 10.8 pt-20 -75.45 -35.19 60.95 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.275 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.476 0 CA-C-O 121.862 0.839 . . . . 0.0 112.732 -177.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.677 HG11 HG22 ' A' ' 5' ' ' VAL . 41.8 t . . . . . 0 N--CA 1.455 -0.223 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.659 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.27 -25.84 61.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.34 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 68.2 m -71.74 -17.56 62.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.933 0.873 . . . . 0.0 109.429 178.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 61.4 tp -78.02 -22.68 48.87 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.269 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 0.3 OUTLIER -68.85 -15.57 63.53 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.444 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -79.57 -39.34 31.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.767 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 36.4 tp60 -74.16 -25.04 59.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.833 0.825 . . . . 0.0 109.037 178.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.89 -45.66 54.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.7 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -68.04 -26.58 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -63.89 -52.97 57.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' C' ' 96' ' ' GLN . 13.3 tp -62.11 -32.36 72.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.632 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.576 ' HA ' HD11 ' A' ' 15' ' ' LEU . 9.0 tt0 -64.31 -35.73 81.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.219 178.68 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.422 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.71 -31.28 77.45 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.84 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.618 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.3 mt-30 -73.88 -47.77 35.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.035 0.445 . . . . 0.0 110.982 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.488 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.5 p -66.27 -36.23 76.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.6 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 17.4 pt20 -65.64 -44.47 86.3 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.664 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.514 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 7.5 p-80 -75.59 -13.46 60.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.651 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.3 mt -74.22 -35.09 63.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -67.79 -35.6 78.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.06 -51.4 69.42 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.508 -1.223 . . . . 0.0 109.378 177.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.724 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.63 -43.41 97.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.884 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.547 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 7.4 m-85 -55.53 -28.24 53.6 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.679 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.7 t -53.66 -27.41 27.32 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.249 0.547 . . . . 0.0 110.775 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.707 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 89.6 mm-40 -94.64 -38.65 10.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.496 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.724 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 36.0 m-85 -77.04 -18.58 58.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.919 0.39 . . . . 0.0 111.675 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.547 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 4.5 tmtt? -58.77 -49.08 78.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.363 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER -89.25 39.65 0.95 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.989 0.899 . . . . 0.0 110.363 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.58 HG21 ' HA ' ' C' ' 113' ' ' GLU . 55.6 t -125.66 -9.87 5.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.734 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.611 ' HG3' HD13 ' B' ' 74' ' ' LEU . 12.1 pt-20 -76.27 -34.24 59.12 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.875 HD22 ' H ' ' B' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 121.909 0.862 . . . . 0.0 112.972 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.641 HG22 HG11 ' A' ' 5' ' ' VAL . 40.2 t . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.15 -26.27 62.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.464 . . . . 0.0 110.414 178.589 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 70.6 m -70.7 -17.65 62.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.917 0.865 . . . . 0.0 109.415 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.673 ' O ' HG13 ' C' ' 92' ' ' VAL . 53.1 tp -79.23 -22.99 44.03 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.654 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -69.79 -12.56 61.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.459 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.433 ' H ' ' HG2' ' C' ' 90' ' ' GLN . 0.4 OUTLIER -81.62 -37.44 27.57 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.742 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.427 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 34.5 tp60 -75.01 -27.11 59.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.906 177.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.673 HG13 ' O ' ' C' ' 88' ' ' LEU . 1.5 m -75.76 -38.08 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.561 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -68.38 -27.87 66.62 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -63.99 -52.41 59.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.15 178.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.606 HD11 ' HA ' ' A' ' 16' ' ' GLN . 13.1 tp -61.47 -33.46 73.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.738 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.608 ' HA ' HD11 ' B' ' 55' ' ' LEU . 10.6 tt0 -63.54 -35.72 81.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.391 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.5 -31.64 78.31 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.755 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.629 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 64.0 mt-30 -74.05 -47.37 37.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.097 0.475 . . . . 0.0 111.137 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.516 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -66.53 -35.58 75.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.811 -179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 16.4 pt20 -66.35 -44.29 83.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.951 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.7 p-80 -75.88 -13.46 60.27 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.629 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 6.2 mt -72.93 -35.84 67.11 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -67.3 -36.03 80.68 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 176.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -56.46 -51.38 68.64 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.621 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.72 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.23 -42.81 99.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.291 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.577 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 15.6 m-85 -56.05 -27.88 55.21 Favored 'General case' 0 C--O 1.214 -0.816 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.563 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 24.1 t -52.99 -26.45 15.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.151 0.5 . . . . 0.0 110.694 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.75 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 91.2 mm-40 -96.49 -37.75 10.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.72 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 37.0 m-85 -78.32 -18.95 54.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.997 0.427 . . . . 0.0 111.494 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' C' ' 106' ' ' PHE . 3.7 tmtt? -58.79 -47.39 84.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.598 -179.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.75 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.2 OUTLIER -90.47 38.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.095 0.95 . . . . 0.0 110.138 178.885 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.582 HG21 ' HA ' ' A' ' 33' ' ' GLU . 53.6 t -124.48 -10.37 6.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.813 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' B' ' 72' ' ' VAL . 10.4 pt-20 -75.37 -36.4 60.95 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.886 HD22 ' H ' ' C' ' 114' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.554 0 CA-C-O 121.979 0.895 . . . . 0.0 113.023 -177.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 90.2 t . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.958 0.409 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.971 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.99 -25.77 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.832 179.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 67.7 m -71.69 -22.31 61.67 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.463 ' HA ' ' HG2' ' A' ' 11' ' ' GLN . 62.1 tp -78.92 -26.3 43.69 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.799 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.971 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -64.23 -49.0 73.68 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.491 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.4 pt20 -61.99 -48.5 80.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.108 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 8' ' ' LEU . 15.8 pt20 -68.41 -21.24 64.69 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.198 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.36 -34.92 21.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.616 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.9 mt-10 -70.1 -28.03 65.08 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.91 -58.57 5.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.177 178.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -62.01 -36.28 81.07 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.703 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.616 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 3.8 pt20 -71.06 -22.3 62.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.682 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -69.05 -32.8 73.35 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.056 -1.068 . . . . 0.0 110.655 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 54.1 mt-30 -72.65 -49.85 29.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.47 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.708 ' HB ' HG21 ' B' ' 59' ' ' VAL . 2.9 p -67.42 -28.71 43.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.833 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.682 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 13.2 pt20 -67.38 -43.93 80.2 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -77.73 -18.34 56.64 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.139 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 44.9 mt -72.24 -40.27 67.85 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.592 ' HB2' HD11 ' C' ' 102' ' ' LEU . 19.8 tm0? -70.79 -36.85 73.22 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -54.87 41.8 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.098 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.58 -44.39 97.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.402 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.688 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.93 -26.53 36.75 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.422 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -50.15 -24.79 2.98 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.88 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.717 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 99.0 mm-40 -102.27 -41.09 6.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.375 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.5 m-85 -73.28 -19.59 61.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -178.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 26' ' ' PHE . 43.1 mtmt -69.95 -8.86 52.33 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.855 0.359 . . . . 0.0 110.726 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.717 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.81 37.05 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.74 0.781 . . . . 0.0 109.78 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.621 HG23 ' HA ' ' A' ' 29' ' ' TYR . 8.2 t -100.95 -43.27 10.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.134 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.492 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 31.9 tt0 -87.4 88.92 7.81 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 122.613 1.196 . . . . 0.0 111.259 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.587 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.034 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.552 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 96.6 t . . . . . 0 N--CA 1.455 -0.178 0 CA-C-O 120.665 0.269 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.995 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.36 -25.6 61.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.869 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.682 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 66.4 m -71.86 -21.92 61.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.457 ' HA ' ' HG2' ' B' ' 51' ' ' GLN . 62.3 tp -79.29 -26.46 42.3 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.434 177.222 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.995 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -63.34 -49.46 73.84 Favored 'General case' 0 N--CA 1.461 0.106 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.25 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.5 pt20 -62.21 -48.25 80.82 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.295 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 48' ' ' LEU . 15.9 pt20 -68.21 -21.64 64.84 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 120.145 -0.622 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -34.79 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.607 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 48.4 mt-10 -69.54 -30.13 67.88 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -62.99 -59.12 5.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.521 178.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -61.6 -35.47 77.96 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 4.0 pt20 -71.57 -22.21 61.77 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.769 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.696 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -68.9 -33.97 76.14 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.771 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 55.5 mt-30 -71.48 -48.95 45.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.069 0.461 . . . . 0.0 110.575 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.711 ' HB ' HG11 ' C' ' 99' ' ' VAL . 2.9 p -68.77 -28.05 38.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.814 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 13.3 pt20 -67.7 -43.26 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.439 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -78.31 -19.11 54.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.991 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 50.7 mt -71.55 -40.73 69.84 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.597 ' HB2' HD11 ' A' ' 22' ' ' LEU . 19.4 tm0? -70.29 -37.34 74.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.45 -55.33 35.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.149 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.691 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.18 -44.75 96.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.377 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.696 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.84 -26.5 35.63 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.336 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -48.9 -27.49 3.13 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.984 0.421 . . . . 0.0 110.595 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.758 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 96.7 mm-40 -99.92 -41.14 7.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.725 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.691 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 38.6 m-85 -72.85 -19.83 61.23 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 66' ' ' PHE . 41.5 mtmt -69.5 -8.34 46.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.67 0.271 . . . . 0.0 110.745 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.758 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -129.44 38.12 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.133 0.968 . . . . 0.0 109.782 178.443 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.633 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 10.4 t -101.61 -43.57 10.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.809 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.531 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 31.4 tt0 -87.68 89.38 7.97 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 122.742 1.258 . . . . 0.0 111.314 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.585 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.29 -2.003 0 CA-C-N 112.313 -2.221 . . . . 0.0 109.4 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 84.7 t . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 120.939 0.4 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 1.04 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.62 -25.24 61.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.845 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 64.2 m -72.48 -21.21 61.25 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.48 ' HA ' ' HG2' ' C' ' 91' ' ' GLN . 63.4 tp -79.9 -26.3 40.27 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.626 177.312 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 1.04 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.7 OUTLIER -64.23 -48.14 76.95 Favored 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.5 pt20 -63.5 -47.7 80.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.931 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' C' ' 88' ' ' LEU . 16.1 pt20 -69.21 -20.51 63.98 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 119.999 -0.68 . . . . 0.0 111.0 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.05 -34.68 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.604 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.4 mt-10 -69.86 -30.32 67.76 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -61.58 -59.8 4.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.088 -1.415 . . . . 0.0 110.092 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.69 -38.81 89.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.455 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.662 ' HA ' HG23 ' C' ' 99' ' ' VAL . 3.7 pt20 -66.64 -22.1 66.11 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.564 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -68.6 -32.95 75.38 Favored Glycine 0 C--O 1.24 0.473 0 C-N-CA 120.084 -1.055 . . . . 0.0 110.753 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.793 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 25.4 mt-30 -72.04 -46.97 54.99 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.711 HG11 ' HB ' ' B' ' 59' ' ' VAL . 0.2 OUTLIER -64.77 -37.55 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.125 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 14.6 pt20 -62.34 -42.14 99.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -177.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -80.48 -17.83 50.45 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.44 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 48.4 mt -73.53 -40.49 63.96 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.557 ' HB2' HD11 ' B' ' 62' ' ' LEU . 20.1 tm0? -71.1 -37.57 72.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.88 28.53 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.043 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.85 -44.08 97.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.46 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.693 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -55.0 -25.23 28.53 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.596 -179.82 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 32.0 t -51.33 -26.23 7.25 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.09 0.471 . . . . 0.0 110.887 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.724 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 99.2 mm-40 -100.72 -40.76 7.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.321 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.756 ' HA ' HG13 ' C' ' 112' ' ' VAL . 39.5 m-85 -73.1 -19.21 61.2 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' C' ' 106' ' ' PHE . 43.9 mtmt -69.53 -8.88 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.652 0.263 . . . . 0.0 110.435 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.724 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -127.85 34.41 4.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.599 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.756 HG13 ' HA ' ' C' ' 109' ' ' TYR . 0.8 OUTLIER -103.44 -35.03 3.6 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.399 177.759 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 31.3 tt0 -85.85 87.24 7.38 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.849 1.309 . . . . 0.0 110.454 178.241 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.601 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.29 -2.0 0 CA-C-N 112.14 -2.3 . . . . 0.0 109.313 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.437 HG22 HG11 ' B' ' 45' ' ' VAL . 91.1 t . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.58 -29.52 68.9 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.681 179.081 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.0 m -67.03 -23.41 65.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.394 0.616 . . . . 0.0 109.736 178.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.576 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 68.0 tp -79.39 -24.66 42.45 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.449 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 12.7 mmm-85 -71.83 -33.69 68.7 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -75.19 -42.61 55.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.379 179.093 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 7' ' ' SER . 97.3 mm-40 -65.2 -32.8 74.66 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.401 0.619 . . . . 0.0 110.308 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -77.91 -26.94 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.172 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -69.55 -30.62 68.47 Favored 'General case' 0 C--O 1.227 -0.091 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.14 -51.41 46.39 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.69 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 52.1 mt -58.7 -31.92 68.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.073 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.444 ' HA ' HG12 ' A' ' 19' ' ' VAL . 21.1 tt0 -70.6 -48.26 56.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.711 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -59.61 -29.69 67.36 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.602 -0.809 . . . . 0.0 111.435 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -73.35 -50.51 21.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.045 0.45 . . . . 0.0 111.065 179.579 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.444 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.5 p -67.62 -31.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.5 pt20 -70.45 -41.53 72.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.811 -0.177 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -78.07 -18.31 55.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.239 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 15.3 mt -71.19 -40.29 71.31 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.001 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.465 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.4 OUTLIER -71.14 -34.01 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.68 31.44 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.296 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.669 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.96 -39.08 93.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.479 178.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -55.73 -26.49 45.71 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.516 179.459 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.9 t -50.2 -32.54 16.69 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.225 0.536 . . . . 0.0 110.371 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.781 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 16.2 mm100 -87.88 -53.69 4.62 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.342 177.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 14.1 m-85 -60.7 -20.59 61.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 14.7 mttp -66.11 -35.35 80.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.497 0.189 . . . . 0.0 110.822 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -100.35 33.17 2.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.232 0.539 . . . . 0.0 110.825 179.591 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.663 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 67.5 t -97.24 -43.97 12.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.708 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' C' ' 112' ' ' VAL . 7.0 tt0 -119.74 105.48 11.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.315 1.055 . . . . 0.0 109.583 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.561 HD13 ' HA ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.67 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.007 -178.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.437 HG11 HG22 ' A' ' 5' ' ' VAL . 85.6 t . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.666 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.87 -29.15 68.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.811 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.678 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 53.7 m -67.29 -23.33 65.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.42 0.628 . . . . 0.0 109.847 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.569 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 66.8 tp -79.57 -24.6 41.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.295 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.666 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 13.2 mmm-85 -71.62 -33.44 68.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.678 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -75.8 -41.81 51.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.425 179.221 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 47' ' ' SER . 97.2 mm-40 -65.57 -33.42 75.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.563 0.697 . . . . 0.0 110.083 178.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.569 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 0.3 OUTLIER -76.99 -27.07 16.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.261 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -69.58 -31.35 69.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -67.6 -50.72 56.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.077 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 52.6 mt -59.04 -32.47 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.967 179.482 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.43 ' HA ' HG12 ' B' ' 59' ' ' VAL . 22.6 tt0 -70.26 -48.0 58.78 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.715 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.97 -29.13 67.29 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.515 -0.85 . . . . 0.0 111.653 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.75 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.8 OUTLIER -74.03 -50.05 21.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.936 0.398 . . . . 0.0 110.96 179.453 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' B' ' 56' ' ' GLN . 14.8 p -67.84 -31.8 53.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 122.131 -0.356 . . . . 0.0 111.902 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.6 pt20 -70.23 -41.74 73.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.779 -0.192 . . . . 0.0 110.836 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -78.17 -18.38 55.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.762 -0.775 . . . . 0.0 110.463 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 16.5 mt -71.41 -39.16 71.29 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.455 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.85 -33.72 68.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.448 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.51 -55.19 38.03 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.3 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.654 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.41 -39.21 93.88 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.354 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.521 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -55.95 -26.13 46.6 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.457 179.329 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -50.74 -31.78 17.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.201 0.524 . . . . 0.0 110.226 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.754 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 15.9 mm100 -88.09 -53.51 4.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.413 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.654 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 13.2 m-85 -60.97 -20.95 63.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 14.7 mttp -65.66 -36.08 82.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.877 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.754 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -99.6 33.11 2.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.481 0.658 . . . . 0.0 110.989 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.648 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 62.5 t -96.82 -43.55 12.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.789 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -120.29 105.61 11.09 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.301 1.048 . . . . 0.0 109.733 176.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.565 HD13 ' HA ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.644 0 CA-C-N 112.771 -2.013 . . . . 0.0 108.686 -178.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.411 HG11 HG22 ' B' ' 45' ' ' VAL . 88.0 t . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.77 -29.42 68.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.924 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 54.4 m -67.05 -23.78 65.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.471 0.653 . . . . 0.0 109.524 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.631 ' O ' HG22 ' C' ' 92' ' ' VAL . 66.9 tp -78.15 -25.6 47.38 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.78 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.599 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 10.2 mmm-85 -72.5 -31.14 65.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -76.26 -40.81 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.474 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 87' ' ' SER . 97.4 mm-40 -65.82 -34.45 78.18 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.631 HG22 ' O ' ' C' ' 88' ' ' LEU . 1.1 m -74.59 -28.99 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.468 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -65.94 -32.44 73.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.53 -52.53 37.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.912 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.409 HD21 ' HB2' ' A' ' 16' ' ' GLN . 0.3 OUTLIER -56.75 -34.44 67.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.119 178.929 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.443 ' HA ' HG12 ' C' ' 99' ' ' VAL . 22.0 tt0 -69.68 -48.07 60.99 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.655 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -59.39 -29.62 66.6 Favored Glycine 0 C--O 1.237 0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.545 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.739 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 0.7 OUTLIER -74.17 -50.44 19.29 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.406 -0.397 . . . . 0.0 111.047 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.9 p -67.5 -31.88 54.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 17.0 pt20 -70.02 -42.3 73.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.942 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -77.58 -18.1 57.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.589 -0.845 . . . . 0.0 110.253 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.6 mt -71.26 -39.57 71.51 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.586 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.7 OUTLIER -71.1 -34.99 71.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.27 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.89 -56.07 26.36 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.425 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.658 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.7 -38.28 89.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.584 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.514 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.89 -26.12 58.26 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.439 179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.1 t -50.37 -32.66 18.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.095 0.474 . . . . 0.0 109.951 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.773 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 15.9 mm100 -87.68 -53.02 5.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.645 177.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.665 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 13.2 m-85 -61.6 -20.54 63.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 14.5 mttp -65.91 -36.06 82.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.635 0.255 . . . . 0.0 110.686 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -99.3 33.03 2.54 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.157 0.503 . . . . 0.0 111.055 179.241 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.665 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 60.0 t -96.94 -43.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.852 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.401 ' HB2' ' CG2' ' B' ' 72' ' ' VAL . 6.4 tt0 -120.47 105.66 11.08 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 122.45 1.119 . . . . 0.0 109.741 176.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.763 0 CA-C-N 112.783 -2.008 . . . . 0.0 108.84 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 121.046 0.45 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.738 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.12 -24.17 65.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.282 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -68.04 -29.01 67.89 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-O 121.721 0.772 . . . . 0.0 109.125 178.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 51.1 tp -75.75 -22.4 56.54 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.152 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.738 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 41.3 mmm-85 -65.77 -37.58 86.72 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.03 -43.79 81.9 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.656 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.9 tt0 -63.6 -31.3 72.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.89 0.852 . . . . 0.0 109.61 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.55 -28.91 29.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.769 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.579 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 58.0 mt-10 -68.15 -29.47 68.36 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.01 -55.4 12.76 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.314 177.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.9 mm? -59.8 -36.84 77.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.827 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HA ' HG12 ' A' ' 19' ' ' VAL . 10.4 pt20 -75.13 -26.83 59.48 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.181 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.497 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.63 -33.49 76.4 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 177.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 93.1 mm-40 -70.76 -48.62 53.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.837 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 16' ' ' GLN . 6.1 p -67.43 -33.96 65.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.497 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 5.8 pt20 -66.6 -45.7 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.941 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.498 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.9 p-80 -74.57 -17.52 60.71 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 119.736 -0.786 . . . . 0.0 110.433 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.8 mt -72.05 -37.8 69.6 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.706 ' HG2' HD21 ' C' ' 102' ' ' LEU . 74.1 mt-30 -70.88 -30.38 66.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.43 -59.19 5.52 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.465 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.503 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.43 -39.68 91.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.117 178.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -56.27 -26.61 52.41 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -59.22 -28.18 66.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.822 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.644 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 14.5 mm100 -89.59 -33.87 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.561 ' CE1' ' HB3' ' B' ' 73' ' ' GLU . 21.6 m-85 -78.45 -18.4 54.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.581 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.491 ' HA ' ' OH ' ' C' ' 109' ' ' TYR . 8.5 tmtt? -55.47 -46.73 76.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.303 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.756 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -91.13 37.29 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.408 0.623 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.691 HG11 HG12 ' B' ' 72' ' ' VAL . 96.2 t -121.19 3.85 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.97 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.56 ' HB3' ' CE1' ' C' ' 109' ' ' TYR . 9.5 pt-20 -93.85 -27.63 16.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 O-C-N 121.681 -0.637 . . . . 0.0 112.288 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.633 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 121.479 0.657 . . . . 0.0 110.499 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.875 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.34 -23.65 65.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.157 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.648 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 68.1 m -68.38 -28.41 67.08 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.856 0.836 . . . . 0.0 109.35 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.61 -22.54 54.04 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.885 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 41.7 mmm-85 -65.25 -38.59 90.8 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -66.58 -43.8 83.95 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.048 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 38.6 tt0 -62.96 -31.87 73.07 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.983 0.897 . . . . 0.0 109.377 178.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -29.58 32.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.841 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 53' ' ' GLU . . . . . 0.567 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 54.9 mt-10 -67.45 -28.37 67.82 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.01 -55.69 10.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.18 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' B' ' 55' ' ' LEU . 3.0 mm? -59.27 -37.46 77.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.739 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.568 ' HA ' HG12 ' B' ' 59' ' ' VAL . 9.4 pt20 -74.43 -27.36 60.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.487 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.507 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.7 -32.78 74.74 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.748 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 94.4 mm-40 -70.65 -49.2 49.89 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 121.017 0.437 . . . . 0.0 111.011 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.568 HG12 ' HA ' ' B' ' 56' ' ' GLN . 5.7 p -67.2 -33.95 66.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.507 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 6.0 pt20 -66.41 -45.6 79.38 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.119 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.505 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 7.3 p-80 -74.62 -17.76 60.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.451 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.8 mt -71.93 -38.46 69.85 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 73.7 mt-30 -70.23 -30.95 68.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.21 -58.13 9.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.722 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.526 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.05 -40.0 94.28 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.082 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.55 -25.9 53.38 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.083 -179.849 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -59.71 -28.92 67.74 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.639 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' GLN . . . . . 0.686 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 14.5 mm100 -89.07 -33.35 17.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.753 0.311 . . . . 0.0 111.007 179.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.526 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.8 m-85 -78.84 -17.48 55.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.694 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.502 ' HA ' ' OH ' ' A' ' 29' ' ' TYR . 8.7 tmtt? -56.31 -47.32 78.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.377 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.739 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.5 OUTLIER -90.09 37.23 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.184 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.691 HG12 HG11 ' A' ' 32' ' ' VAL . 99.4 t -120.84 2.63 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.074 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.561 ' HB3' ' CE1' ' A' ' 29' ' ' TYR . 9.5 pt-20 -93.02 -26.76 17.37 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.599 -0.688 . . . . 0.0 112.194 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.649 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.355 0 CA-C-O 121.363 0.601 . . . . 0.0 110.295 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.027 0.442 . . . . 0.0 109.855 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.704 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.59 -25.97 66.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.196 179.571 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.638 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 66.7 m -66.64 -28.56 68.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.745 0.783 . . . . 0.0 109.237 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.676 ' O ' HG13 ' C' ' 92' ' ' VAL . 46.5 tp -75.76 -25.07 56.16 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.116 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.704 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 34.8 mmm-85 -65.43 -35.88 82.25 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.638 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.34 -43.26 82.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.364 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -63.6 -32.43 73.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.75 178.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.676 HG13 ' O ' ' C' ' 88' ' ' LEU . 6.0 m -74.91 -23.05 17.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.879 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 93' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 55.8 mt-10 -67.96 -29.81 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.46 -55.1 11.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.135 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.4 mm? -59.1 -37.92 78.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.685 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.62 ' HA ' HG23 ' C' ' 99' ' ' VAL . 10.2 pt20 -73.78 -28.03 61.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.412 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.435 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -67.09 -33.07 82.28 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.736 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 92.6 mm-40 -70.15 -47.26 62.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.159 -0.52 . . . . 0.0 110.422 178.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.62 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.735 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' C' ' 101' ' ' HIS . 10.5 pt20 -59.7 -44.84 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.455 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.529 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.2 p-80 -76.83 -18.82 58.15 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.504 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.2 mt -70.93 -38.24 72.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.704 ' HG2' HD21 ' B' ' 62' ' ' LEU . 72.9 mt-30 -72.08 -30.07 64.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.96 -57.7 11.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.468 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.532 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.62 -40.3 96.54 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.828 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.434 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.15 -25.82 47.87 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.346 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 13.1 t -60.28 -27.83 67.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 0.0 110.72 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' C' C ' 108' ' ' GLN . . . . . 0.678 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 14.6 mm100 -89.75 -32.69 16.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.828 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.56 ' CE1' ' HB3' ' A' ' 33' ' ' GLU . 22.1 m-85 -79.17 -18.29 53.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.664 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.495 ' HA ' ' OH ' ' B' ' 69' ' ' TYR . 9.0 tmtt? -55.46 -47.33 76.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.62 -179.054 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.788 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.4 OUTLIER -90.12 38.08 0.92 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.419 0.628 . . . . 0.0 111.111 179.626 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.686 HG12 HG11 ' B' ' 72' ' ' VAL . 92.7 t -122.15 2.66 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.339 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' B' ' 69' ' ' TYR . 9.8 pt-20 -92.04 -29.55 16.52 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.355 -0.841 . . . . 0.0 112.452 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.544 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.702 0 C-N-CA 124.033 0.933 . . . . 0.0 110.539 178.939 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 45' ' ' VAL . 44.4 t . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.908 0.385 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.53 -34.95 74.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.312 0.577 . . . . 0.0 109.681 178.915 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.9 m -71.9 -19.54 61.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.987 0.898 . . . . 0.0 108.695 177.398 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.556 ' O ' HG23 ' A' ' 12' ' ' VAL . 36.6 tp -72.62 -28.05 62.52 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.442 179.663 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 29.8 mmm-85 -62.42 -22.71 66.39 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.975 179.075 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.2 mt-30 -74.28 -35.66 63.76 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.84 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 99.0 mm-40 -71.53 -25.53 62.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 178.16 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.558 HG13 HD11 ' C' ' 95' ' ' LEU . 60.1 t -75.42 -40.26 42.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.367 178.684 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -62.17 -33.55 74.74 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.73 -55.17 18.76 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 113.974 -1.466 . . . . 0.0 110.772 178.394 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.584 HD11 HG13 ' B' ' 52' ' ' VAL . 78.8 mt -55.11 -45.18 75.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.719 -179.334 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 14.1 pt20 -72.66 -25.2 61.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 -179.553 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.75 -31.78 76.63 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 177.552 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.669 ' HB3' HG11 ' B' ' 59' ' ' VAL . 14.1 mm100 -71.51 -40.34 70.21 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.112 178.392 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' C' ' 98' ' ' GLN . 2.9 t -67.12 -44.98 87.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.523 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.7 pt20 -61.47 -43.09 99.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.678 -178.548 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.1 p-80 -77.75 -17.63 57.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.175 -179.667 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.671 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.2 mp -77.12 -35.54 56.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 120.099 -0.641 . . . . 0.0 109.56 178.518 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HG2' HD21 ' C' ' 102' ' ' LEU . 34.2 mt-30 -74.97 -30.63 61.25 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.29 -53.9 53.04 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.229 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.68 -46.71 86.65 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.508 178.273 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.407 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -47.88 -33.1 7.04 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 123.86 0.725 . . . . 0.0 112.502 179.558 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t -53.96 -34.01 58.53 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.853 0.358 . . . . 0.0 111.582 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -86.05 -12.77 49.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.865 0.364 . . . . 0.0 111.522 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.768 ' O ' HG22 ' A' ' 32' ' ' VAL . 62.4 m-85 -103.74 -16.03 15.56 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.348 0.594 . . . . 0.0 109.509 179.347 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.605 ' HA ' ' HE2' ' C' ' 109' ' ' TYR . 82.5 mttt -63.49 -17.74 63.07 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.443 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.597 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -102.25 22.82 12.65 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.563 179.03 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.768 HG22 ' O ' ' A' ' 29' ' ' TYR . 4.3 m -119.06 -14.72 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 121.838 -0.539 . . . . 0.0 111.964 179.745 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.482 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 10.7 pt-20 -75.43 -28.63 59.44 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.481 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.597 HD11 ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.702 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -175.093 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.722 HG11 HG22 ' A' ' 5' ' ' VAL . 45.0 t . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 120.796 0.331 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 46' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -69.77 -35.73 75.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.486 178.886 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 47' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 32.8 m -69.99 -19.95 63.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.089 0.947 . . . . 0.0 108.63 177.159 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 48' ' ' LEU . . . . . 0.515 ' O ' HG23 ' B' ' 52' ' ' VAL . 33.4 tp -72.29 -28.92 63.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 49' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 31.5 mmm-85 -61.26 -24.14 66.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.949 179.014 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 50' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' B' ' 47' ' ' SER . 5.5 mt-30 -72.67 -36.74 67.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.984 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 98.9 mm-40 -70.45 -26.13 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.496 178.108 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.584 HG13 HD11 ' A' ' 15' ' ' LEU . 57.7 t -74.73 -40.72 47.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.357 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.88 -33.75 74.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.573 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 54' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.21 -55.04 20.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.916 178.273 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 55' ' ' LEU . . . . . 0.534 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -55.53 -44.98 77.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.653 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 56' ' ' GLN . . . . . 0.487 ' O ' ' HG2' ' B' ' 60' ' ' GLN . 13.9 pt20 -72.83 -24.94 60.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 57' ' ' GLY . . . . . 0.502 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.19 -30.9 73.95 Favored Glycine 0 C--O 1.237 0.302 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.705 ' HB3' HG21 ' C' ' 99' ' ' VAL . 14.1 mm100 -72.02 -41.75 67.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.168 -0.516 . . . . 0.0 109.933 178.433 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.669 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.9 t -65.42 -46.21 90.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.402 179.921 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 60' ' ' GLN . . . . . 0.502 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 8.9 pt20 -60.58 -43.01 97.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.762 -178.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 61' ' ' HIS . . . . . 0.489 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.1 p-80 -78.28 -16.82 57.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 62' ' ' LEU . . . . . 0.657 ' HG ' ' HE2' ' C' ' 106' ' ' PHE . 1.2 mp -77.56 -36.29 52.32 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.402 178.453 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.671 ' HG2' HD11 ' A' ' 22' ' ' LEU . 34.4 mt-30 -73.79 -31.49 63.3 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 64' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.1 -54.4 47.17 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.689 177.111 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 65' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' B' ' 69' ' ' TYR . . . -58.27 -47.12 84.61 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.3 178.413 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 66' ' ' PHE . . . . . 0.641 ' HE2' ' HG ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -47.58 -33.09 6.12 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 123.838 0.711 . . . . 0.0 112.682 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -54.58 -33.85 60.96 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 0.0 111.524 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -86.03 -12.22 50.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.912 0.387 . . . . 0.0 111.472 179.371 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 69' ' ' TYR . . . . . 0.789 ' O ' HG22 ' B' ' 72' ' ' VAL . 61.9 m-85 -104.05 -16.67 15.22 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.494 0.664 . . . . 0.0 109.327 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 29' ' ' TYR . 83.5 mttt -62.85 -17.97 62.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.407 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.607 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -101.85 22.53 12.8 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.594 178.716 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 72' ' ' VAL . . . . . 0.789 HG22 ' O ' ' B' ' 69' ' ' TYR . 4.2 m -118.89 -14.4 9.22 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 O-C-N 121.871 -0.518 . . . . 0.0 112.028 179.514 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 73' ' ' GLU . . . . . 0.475 ' HG3' ' HG ' ' B' ' 74' ' ' LEU . 11.5 pt-20 -75.53 -28.55 59.14 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.702 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' B' ' 71' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 -175.09 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 85' ' ' VAL . . . . . 0.681 HG22 HG11 ' A' ' 5' ' ' VAL . 47.2 t . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 109.962 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 86' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.86 -35.93 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.393 0.616 . . . . 0.0 109.678 178.831 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 87' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 44.5 m -70.9 -19.9 62.55 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.057 0.932 . . . . 0.0 108.966 177.265 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 88' ' ' LEU . . . . . 0.54 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 35.9 tp -71.83 -28.56 63.65 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.538 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 89' ' ' ARG . . . . . 0.766 ' HA ' HG13 ' C' ' 92' ' ' VAL . 26.2 mmm-85 -63.09 -22.82 67.12 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.041 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 90' ' ' GLN . . . . . 0.698 ' HG3' ' O ' ' C' ' 87' ' ' SER . 5.1 mt-30 -73.77 -35.25 64.96 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.886 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 91' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 99.0 mm-40 -70.98 -28.7 64.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.976 177.952 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 92' ' ' VAL . . . . . 0.766 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -79.08 -31.49 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 119.982 -0.687 . . . . 0.0 110.359 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -63.37 -34.74 78.37 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 94' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -66.53 -52.43 45.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.244 -1.344 . . . . 0.0 111.256 178.294 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 95' ' ' LEU . . . . . 0.558 HD11 HG13 ' A' ' 12' ' ' VAL . 83.9 mt -56.79 -42.95 80.39 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.788 -1.096 . . . . 0.0 111.464 -179.257 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 96' ' ' GLN . . . . . 0.581 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 13.3 pt20 -74.8 -25.11 58.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.938 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 97' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -68.23 -30.6 73.72 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 177.421 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 98' ' ' GLN . . . . . 0.602 ' HB3' HG11 ' A' ' 19' ' ' VAL . 14.6 mm100 -73.31 -43.12 61.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.934 -0.633 . . . . 0.0 110.495 178.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 99' ' ' VAL . . . . . 0.705 HG21 ' HB3' ' B' ' 58' ' ' GLN . 0.2 OUTLIER -71.52 -34.18 52.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.249 -179.399 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' C' C ' 100' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.5 pt20 -65.32 -43.18 91.8 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.104 177.982 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 101' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.6 p-80 -78.5 -17.33 56.4 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.563 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 102' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 4.0 mt -74.2 -37.82 63.8 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.367 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 103' ' ' GLN . . . . . 0.648 ' HG2' HD11 ' B' ' 62' ' ' LEU . 33.8 mt-30 -72.46 -31.78 65.71 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.584 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 104' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.28 -53.79 54.16 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.543 177.404 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 105' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' C' ' 109' ' ' TYR . . . -59.32 -46.44 88.57 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.556 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 106' ' ' PHE . . . . . 0.657 ' HE2' ' HG ' ' B' ' 62' ' ' LEU . 0.7 OUTLIER -48.19 -32.94 7.73 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.795 0.684 . . . . 0.0 112.119 179.502 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 38.8 t -53.47 -35.7 60.85 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.913 0.387 . . . . 0.0 111.314 -179.425 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -84.93 -12.95 52.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.894 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' C' C ' 109' ' ' TYR . . . . . 0.797 ' O ' HG22 ' C' ' 112' ' ' VAL . 62.8 m-85 -103.43 -16.18 15.67 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.633 0.73 . . . . 0.0 109.418 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 110' ' ' LYS . . . . . 0.598 ' HA ' ' HE2' ' B' ' 69' ' ' TYR . 82.7 mttt -62.69 -18.46 62.49 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.291 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 111' ' ' LYS . . . . . 0.562 ' HA ' HD11 ' C' ' 114' ' ' LEU . 0.2 OUTLIER -101.65 21.85 13.74 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.313 -0.955 . . . . 0.0 111.868 179.046 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' C' C ' 112' ' ' VAL . . . . . 0.797 HG22 ' O ' ' C' ' 109' ' ' TYR . 4.4 m -118.47 -13.57 10.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 O-C-N 121.893 -0.505 . . . . 0.0 112.285 179.469 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 113' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' C' ' 114' ' ' LEU . 10.6 pt-20 -76.85 -28.83 55.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' C' C ' 114' ' ' LEU . . . . . 0.562 HD11 ' HA ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.79 0 CA-C-N 115.031 -0.986 . . . . 0.0 113.578 -175.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.484 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.989 0 N-CA-C 111.941 -0.463 . . . . 0.0 111.941 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.652 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 98.2 mt -58.64 -57.88 23.33 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.043 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.652 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 75.2 Cg_exo -44.98 -46.19 13.34 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.794 2.329 . . . . 0.0 112.785 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.415 ' HA ' ' HB2' ' A' ' 7' ' ' SER . 38.8 t70 -62.61 -31.65 72.52 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.59 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.518 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 78.5 t -58.37 -55.7 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.59 -23.64 65.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.093 178.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.681 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 52.8 m -72.73 -21.26 61.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.571 0.7 . . . . 0.0 110.475 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.7 tp -76.56 -18.72 58.52 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 5.6 mpt_? -73.8 -40.21 63.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.564 178.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.681 ' HG3' ' O ' ' A' ' 7' ' ' SER . 4.0 pt20 -71.93 -30.35 65.24 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 37.4 tt0 -69.63 -28.62 66.06 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 122.116 0.96 . . . . 0.0 108.479 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 t -74.48 -32.73 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 114.273 -1.33 . . . . 0.0 109.444 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.584 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 51.0 mt-10 -71.31 -26.54 62.89 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.32 -41.19 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.477 177.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.3 tp -63.47 -38.42 91.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.385 -1.28 . . . . 0.0 110.107 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.584 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.3 pt20 -77.0 -21.27 54.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.844 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.5 ' HA2' ' OE1' ' A' ' 20' ' ' GLN . . . -71.36 -33.68 64.28 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.658 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 47.8 mm-40 -70.65 -44.6 66.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.472 -0.364 . . . . 0.0 110.474 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.1 p -70.12 -31.69 48.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.734 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.5 ' OE1' ' HA2' ' A' ' 17' ' ' GLY . 16.9 pt20 -71.91 -38.73 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.4 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.658 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 12.0 p-80 -79.96 -18.0 51.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.197 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.713 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 1.8 mp -79.47 -28.81 41.55 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.531 ' HG2' HD11 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -76.97 -29.11 55.4 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.321 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -60.01 -60.92 3.07 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.581 177.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.53 -41.4 94.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.542 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.713 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.04 -28.12 56.1 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.898 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t -60.07 -31.96 70.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.226 0.536 . . . . 0.0 110.77 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -76.82 -48.16 19.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.586 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.628 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 34.5 m-85 -70.89 -15.55 62.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.537 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 37.2 ttmt -66.17 -40.64 90.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.21 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.98 32.41 2.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.738 0.78 . . . . 0.0 110.123 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 6.6 t -94.81 -36.41 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.265 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.414 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 38.5 tt0 -101.89 103.75 14.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 122.493 1.14 . . . . 0.0 110.498 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.699 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -172.84 -27.23 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 112.566 -2.106 . . . . 0.0 108.991 -179.653 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.699 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -132.53 43.94 1.2 Allowed Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.487 176.798 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 39.5 Cg_endo -65.62 -179.21 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 122.486 2.124 . . . . 0.0 113.355 -179.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.96 162.71 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.432 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -179.3 164.48 32.64 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.014 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.04 -156.95 24.72 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.745 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.324 179.729 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.477 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.756 -0.538 . . . . 0.0 111.756 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.638 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 99.2 mt -57.21 -58.08 20.43 Favored Pre-proline 0 N--CA 1.467 0.412 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.564 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.638 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.8 Cg_exo -45.64 -45.43 16.36 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 122.595 2.197 . . . . 0.0 112.773 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.419 ' HA ' ' HB2' ' B' ' 47' ' ' SER . 38.6 t70 -63.27 -30.89 71.94 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.377 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.517 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 70.7 t -58.84 -55.52 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.52 -23.97 65.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.158 178.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.9 m -72.21 -22.09 61.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.436 0.636 . . . . 0.0 110.526 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 23.4 tp -75.82 -18.51 59.45 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 5.4 mpt_? -74.1 -39.38 63.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.516 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.7 pt20 -72.42 -30.77 64.93 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.6 tt0 -69.14 -28.25 66.28 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.105 0.955 . . . . 0.0 108.518 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -75.32 -32.74 26.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 114.44 -1.254 . . . . 0.0 109.453 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.573 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 49.0 mt-10 -70.94 -26.39 63.17 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.92 -42.03 73.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.447 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 37.1 tp -63.07 -38.38 90.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.334 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 10.7 pt20 -76.95 -20.77 55.74 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.836 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.481 ' HA2' ' OE1' ' B' ' 60' ' ' GLN . . . -72.13 -33.64 62.02 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 177.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.637 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 45.3 mm-40 -70.04 -44.75 68.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.954 0.407 . . . . 0.0 110.357 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.2 p -69.89 -32.12 50.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.891 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.481 ' OE1' ' HA2' ' B' ' 57' ' ' GLY . 16.8 pt20 -71.89 -38.77 69.93 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.347 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.637 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 11.3 p-80 -79.78 -17.68 52.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.41 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.732 ' O ' ' HB2' ' B' ' 66' ' ' PHE . 1.9 mp -79.93 -29.12 39.67 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.55 ' HG2' HD11 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -75.85 -29.22 58.49 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.322 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -59.85 -61.66 2.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.627 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.43 -41.53 89.78 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.66 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.732 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.94 -29.15 59.69 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.108 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.5 t -58.56 -34.06 70.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.004 0.366 . . . . 0.0 110.648 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.431 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 60.8 mm-40 -75.21 -47.92 25.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.328 0.585 . . . . 0.0 109.9 178.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.622 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 33.9 m-85 -70.94 -16.13 62.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 37.1 ttmt -66.51 -39.98 88.97 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.443 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.482 ' H ' ' HG3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -98.23 31.39 2.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.684 0.754 . . . . 0.0 109.908 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.622 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -93.82 -36.66 7.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.267 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -102.25 101.86 12.19 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.532 1.158 . . . . 0.0 111.145 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.699 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -170.55 -27.18 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 112.411 -2.177 . . . . 0.0 108.837 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.699 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -131.58 43.92 1.23 Allowed Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.454 176.892 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 39.0 Cg_endo -65.58 -179.19 1.13 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.254 1.969 . . . . 0.0 113.629 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -82.61 162.7 21.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.156 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.99 165.63 34.7 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.616 -0.802 . . . . 0.0 111.796 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.9 -156.61 25.57 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.201 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 5.2 tt . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.273 179.869 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.519 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.93 -0.468 . . . . 0.0 111.93 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.678 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 98.0 mt -59.62 -56.53 34.88 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 119.414 -0.326 . . . . 0.0 111.718 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.678 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 74.4 Cg_exo -46.34 -45.46 18.73 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 122.907 2.405 . . . . 0.0 112.818 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 84' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' C' ' 87' ' ' SER . 35.8 t70 -62.53 -33.28 74.59 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.484 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.559 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 76.3 t -57.18 -55.81 18.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.55 -24.14 65.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.247 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 56.1 m -72.01 -22.02 61.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.539 0.685 . . . . 0.0 110.207 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.696 ' O ' HG13 ' C' ' 92' ' ' VAL . 25.6 tp -75.69 -19.12 59.34 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.693 ' O ' HG22 ' C' ' 92' ' ' VAL . 4.6 mpt_? -75.94 -36.94 59.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.313 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 4.0 pt20 -73.26 -29.49 62.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.464 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.5 tt0 -69.77 -30.33 67.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 177.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.696 HG13 ' O ' ' C' ' 88' ' ' LEU . 16.0 m -75.85 -27.9 18.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.738 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.563 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 52.3 mt-10 -70.26 -28.17 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -70.11 -41.0 74.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.542 177.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 40.2 tp -63.77 -37.52 87.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.27 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.563 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 10.9 pt20 -77.69 -21.35 52.16 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.727 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.495 ' HA2' ' OE1' ' C' ' 100' ' ' GLN . . . -71.22 -34.07 64.51 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.661 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 43.1 mm-40 -69.84 -44.87 69.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.317 178.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' C' ' 96' ' ' GLN . 10.0 p -70.22 -30.99 45.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.104 -0.639 . . . . 0.0 112.204 -178.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.495 ' OE1' ' HA2' ' C' ' 97' ' ' GLY . 16.4 pt20 -72.69 -38.86 67.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.001 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.661 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 12.3 p-80 -80.07 -17.16 53.41 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 119.448 -0.901 . . . . 0.0 110.21 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' C' ' 106' ' ' PHE . 1.8 mp -79.79 -29.27 40.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -76.91 -28.83 55.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 176.359 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.84 -61.86 2.3 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.514 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.517 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.12 -41.5 88.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.648 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.647 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.01 -31.44 61.05 Favored 'General case' 0 C--O 1.204 -1.313 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.724 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.4 t -55.74 -34.62 65.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.902 0.382 . . . . 0.0 110.728 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.414 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 55.4 mm-40 -75.38 -49.11 20.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.302 0.572 . . . . 0.0 109.967 178.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.616 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 32.7 m-85 -70.36 -16.13 62.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.792 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' C' ' 106' ' ' PHE . 30.1 ttmt -69.32 -34.67 75.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.647 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.469 ' H ' ' HG3' ' C' ' 111' ' ' LYS . 0.0 OUTLIER -101.5 30.66 4.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.452 0.644 . . . . 0.0 109.582 177.721 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.616 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.2 t -93.47 -37.25 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.337 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 37.2 tt0 -101.45 102.71 13.55 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-O 122.404 1.097 . . . . 0.0 110.559 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.721 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -170.77 -28.56 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.792 -179.753 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.721 ' H ' HD23 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -131.15 44.38 1.37 Allowed Pre-proline 0 CA--C 1.55 0.972 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.288 176.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 44.0 Cg_endo -66.33 179.36 2.04 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 122.233 1.956 . . . . 0.0 113.309 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -79.98 164.26 23.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.467 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 179.3 165.37 33.4 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.811 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 88.55 -160.8 30.6 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.157 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.45 179.932 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.41 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.937 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.589 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 91.0 mt -60.0 -56.02 39.75 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.099 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 76.9 Cg_exo -42.41 -48.67 6.68 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 123.081 2.521 . . . . 0.0 113.179 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -57.7 -44.5 85.93 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.017 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 1' ' ' GLY . 93.5 t -61.58 -51.27 74.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.621 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.67 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.86 -27.34 68.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.511 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 75.2 m -67.7 -28.46 67.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.07 0.462 . . . . 0.0 109.847 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.2 tp -75.48 -21.66 57.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.622 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.719 ' HA ' HG22 ' A' ' 12' ' ' VAL . 39.0 mmm-85 -65.4 -21.53 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.3 mt-30 -73.39 -42.83 61.66 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -70.86 -29.29 65.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.782 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.719 HG22 ' HA ' ' A' ' 9' ' ' ARG . 28.3 m -76.42 -40.87 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.634 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.82 -24.13 61.67 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -55.29 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.552 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' B' ' 56' ' ' GLN . 12.3 tp -58.92 -34.12 71.36 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.295 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 15.4 tt0 -67.12 -38.31 85.37 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.484 179.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -61.4 -31.72 78.39 Favored Glycine 0 C--O 1.237 0.324 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.753 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.684 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 95.6 mm-40 -72.94 -49.95 26.37 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.519 HG11 HD22 ' C' ' 95' ' ' LEU . 10.2 p -66.41 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.3 pt20 -68.88 -42.97 76.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.099 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.544 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.8 p-80 -75.81 -17.29 59.9 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.8 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.684 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 12.3 mt -73.57 -37.3 65.56 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 176.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.6 tm0? -70.65 -29.26 65.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.38 -62.13 2.07 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.086 178.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.478 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.18 -41.15 92.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.08 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.609 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -56.04 -28.98 59.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.12 -179.85 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.0 t -61.6 -31.88 71.96 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.028 0.442 . . . . 0.0 110.259 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.97 -52.04 14.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.59 0.71 . . . . 0.0 109.508 178.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.534 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 56.8 m-85 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.238 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.29 -41.1 98.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.851 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.495 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -96.36 29.67 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.49 0.662 . . . . 0.0 111.272 179.56 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.554 HG21 ' HB2' ' B' ' 73' ' ' GLU . 3.5 t -96.3 -41.12 11.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.594 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.729 ' HB2' HG11 ' C' ' 112' ' ' VAL . 19.3 tt0 -102.74 105.43 15.87 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.63 0.729 . . . . 0.0 109.833 177.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.83 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -175.56 -31.43 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.36 -179.236 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.83 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -121.62 19.06 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.763 ' HD3' ' H ' ' A' ' 34' ' ' LEU . 44.4 Cg_endo -86.87 -158.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.367 1.523 0 CA-C-N 121.684 1.637 . . . . 0.0 112.409 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -114.98 -152.27 0.5 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.997 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.545 ' HA2' ' HE2' ' C' ' 115' ' ' PHE . . . 143.72 -117.8 1.12 Allowed Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -82.78 -4.94 89.84 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.505 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 12.4 tt . . . . . 0 C--O 1.244 0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.792 179.855 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.41 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.487 2.043 0 N-CA-C 111.926 -0.469 . . . . 0.0 111.926 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.595 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 91.8 mt -60.37 -56.37 35.97 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.229 -0.415 . . . . 0.0 111.431 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.595 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.6 Cg_exo -41.4 -49.26 5.06 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.169 2.58 . . . . 0.0 113.211 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.14 -46.02 83.05 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 41' ' ' GLY . 86.4 t -60.92 -50.81 79.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.593 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.644 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.24 -27.62 68.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.443 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.664 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 69.7 m -67.68 -27.89 67.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.011 0.434 . . . . 0.0 109.965 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.46 -21.56 58.0 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.574 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.734 ' HA ' HG22 ' B' ' 52' ' ' VAL . 39.5 mmm-85 -65.38 -21.97 66.74 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.664 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.0 mt-30 -72.99 -42.09 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.623 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -71.85 -28.48 63.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.51 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' B' ' 49' ' ' ARG . 30.4 m -77.06 -42.25 31.65 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.444 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.95 -25.3 63.57 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.13 -55.2 17.59 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.623 HD11 ' HA ' ' C' ' 96' ' ' GLN . 12.5 tp -59.27 -33.5 71.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.382 -1.281 . . . . 0.0 110.251 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.59 ' HA ' HD11 ' A' ' 15' ' ' LEU . 14.3 tt0 -67.15 -39.2 86.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.521 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.507 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -61.06 -31.72 77.72 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.766 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.701 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 96.0 mm-40 -72.76 -49.5 30.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.02 0.438 . . . . 0.0 111.114 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.445 HG12 ' HA ' ' B' ' 56' ' ' GLN . 9.8 p -66.99 -32.18 56.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 8.0 pt20 -69.96 -42.87 72.6 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.986 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.539 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.8 p-80 -75.74 -17.29 59.96 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.671 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 12.0 mt -73.34 -37.11 66.22 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.495 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.2 tm0? -70.6 -29.98 66.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.39 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.068 178.282 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.459 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.37 -40.99 88.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.134 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.618 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.2 OUTLIER -56.62 -28.7 61.06 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.225 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.1 t -62.0 -30.68 71.11 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.212 0.53 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -75.07 -51.21 14.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.584 0.706 . . . . 0.0 109.389 178.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 61.0 m-85 -66.28 -16.42 64.01 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.299 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.67 -41.79 98.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.879 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.505 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -95.83 29.42 2.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.362 0.601 . . . . 0.0 111.543 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' C' ' 113' ' ' GLU . 3.6 t -96.28 -40.24 10.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.457 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.554 ' HB2' HG21 ' A' ' 32' ' ' VAL . 19.1 tt0 -103.68 105.36 15.56 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 122.011 0.91 . . . . 0.0 109.922 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.799 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -175.63 -31.38 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.316 -179.316 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.799 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -121.89 18.83 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 178.923 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.749 ' HD3' ' H ' ' B' ' 74' ' ' LEU . 41.9 Cg_endo -87.62 -159.53 0.09 OUTLIER 'Trans proline' 0 C--N 1.365 1.427 0 CA-C-N 121.52 1.579 . . . . 0.0 112.057 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -114.12 -151.85 0.49 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.1 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' GLY . . . . . 0.535 ' HA2' ' HE2' ' A' ' 35' ' ' PHE . . . 144.63 -115.29 0.85 Allowed Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.24 -5.87 84.94 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.527 -0.845 . . . . 0.0 111.218 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 10.4 tt . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.098 179.879 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.591 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 91.0 mt -56.91 -56.47 32.89 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.277 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.591 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 78.1 Cg_exo -42.41 -48.63 6.71 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 123.173 2.582 . . . . 0.0 113.226 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.49 -45.11 85.26 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.023 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 97.8 t -61.1 -51.95 67.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.793 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.686 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.42 -26.97 68.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.394 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 75.5 m -68.07 -28.32 67.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 0.0 109.956 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.36 -21.54 58.26 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.333 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.686 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 42.6 mmm-85 -63.92 -23.65 67.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.694 178.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' C' ' 87' ' ' SER . 3.0 mt-30 -72.48 -44.55 62.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.169 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -69.26 -27.46 65.45 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.788 0.804 . . . . 0.0 110.795 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.27 -45.11 35.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.525 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.4 -21.8 61.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -55.47 13.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.375 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.519 HD22 HG11 ' A' ' 19' ' ' VAL . 1.4 mt -56.46 -38.18 71.31 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.118 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.623 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.0 tt0 -64.23 -38.98 92.97 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.163 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.503 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.88 -31.65 79.12 Favored Glycine 0 C--O 1.238 0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.587 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.697 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 96.2 mm-40 -73.04 -50.04 25.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 111.189 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.492 HG12 ' HA ' ' C' ' 96' ' ' GLN . 9.6 p -66.37 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 8.0 pt20 -68.94 -43.41 75.12 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.026 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.553 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 6.6 p-80 -75.53 -17.06 60.19 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.967 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 12.8 mt -74.25 -36.62 63.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.534 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.1 tm0? -70.94 -29.18 65.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.19 -63.07 1.39 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.829 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.465 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.39 -42.01 90.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.136 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.635 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.2 OUTLIER -55.57 -29.1 58.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.174 -0.921 . . . . 0.0 112.308 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 10.6 t -61.98 -30.62 71.06 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.028 0.442 . . . . 0.0 110.653 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -75.56 -51.1 13.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.594 0.712 . . . . 0.0 109.401 178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.634 ' HA ' HG13 ' C' ' 112' ' ' VAL . 58.7 m-85 -66.03 -17.38 64.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.016 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -60.76 -39.49 88.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.08 -0.963 . . . . 0.0 110.907 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.501 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.56 26.64 4.83 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.729 HG11 ' HB2' ' A' ' 33' ' ' GLU . 1.1 m -99.41 -30.58 3.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.816 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.542 ' HB2' HG21 ' B' ' 72' ' ' VAL . 18.4 tt0 -102.95 103.22 13.33 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 121.922 0.868 . . . . 0.0 109.566 176.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.849 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -176.17 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 113.399 -1.728 . . . . 0.0 110.329 -179.111 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.849 ' H ' HD23 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -121.15 18.77 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.053 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.759 ' HD3' ' H ' ' C' ' 114' ' ' LEU . 60.6 Cg_endo -86.93 -159.2 0.09 OUTLIER 'Trans proline' 0 C--N 1.37 1.676 0 CA-C-N 121.504 1.573 . . . . 0.0 112.308 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -114.25 -149.4 0.45 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 118' ' ' GLY . . . . . 0.568 ' HA2' ' HE2' ' B' ' 75' ' ' PHE . . . 142.05 -115.6 0.99 Allowed Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.37 -6.41 83.97 Favored Glycine 0 N--CA 1.454 -0.149 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.567 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 11.5 tt . . . . . 0 C--O 1.245 0.858 0 CA-C-O 118.594 -0.717 . . . . 0.0 110.187 -179.859 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.487 2.045 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.432 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 9.7 mp -56.7 -57.1 26.03 Favored Pre-proline 0 N--CA 1.464 0.271 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.575 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 50.1 Cg_exo -42.28 -48.27 6.7 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 123.141 2.561 . . . . 0.0 113.459 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -45.8 88.56 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.923 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.563 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 85.2 t -62.07 -36.33 73.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.257 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.28 -33.47 69.79 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.708 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -69.45 -20.25 63.76 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.416 1.103 . . . . 0.0 108.294 177.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 28.6 tp -76.3 -29.65 57.43 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.323 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.606 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 22.6 mmm-85 -66.37 -39.94 89.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.074 0.464 . . . . 0.0 109.997 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.708 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -69.76 -41.93 74.54 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.14 179.694 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 61.1 tt0 -66.62 -34.94 79.0 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.104 0.478 . . . . 0.0 111.377 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 9' ' ' ARG . 5.7 p -76.97 -30.88 18.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -69.98 -30.56 67.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.47 -56.29 13.22 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.716 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.2 tp -58.39 -34.52 70.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.054 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.458 ' HA ' HD11 ' C' ' 95' ' ' LEU . 19.7 tt0 -65.27 -44.29 88.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.688 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.526 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -61.13 -31.31 76.33 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.625 179.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 69.8 mt-30 -71.95 -43.71 64.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.898 0.38 . . . . 0.0 110.584 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.2 t -67.52 -40.93 85.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.839 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 20.8 pt20 -61.98 -42.12 98.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.059 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.3 p-80 -79.78 -17.16 54.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.771 -0.772 . . . . 0.0 111.024 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 11.5 mt -71.64 -41.19 69.1 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -70.82 -31.97 68.88 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.66 -55.43 34.98 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.755 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.673 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.89 -39.94 93.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.693 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.416 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -55.05 -29.67 57.97 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.381 179.43 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -49.83 -26.87 4.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.029 0.442 . . . . 0.0 111.122 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.451 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 55.8 mm-40 -96.66 -42.82 7.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.921 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.1 m-85 -73.58 -20.4 60.63 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -178.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 51.5 mtmt -70.38 -26.95 63.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.78 0.324 . . . . 0.0 110.64 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.64 31.6 5.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.74 0.781 . . . . 0.0 109.738 178.566 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.631 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 2.9 t -93.38 -42.12 12.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.238 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -97.71 100.05 11.43 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 122.336 1.065 . . . . 0.0 110.687 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.678 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -171.58 -29.14 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 112.742 -2.026 . . . . 0.0 109.615 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.746 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 43.0 m-85 -63.07 -56.68 26.03 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.988 178.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.746 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 86.2 Cg_endo -83.66 172.49 10.11 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.28 1.987 . . . . 0.0 111.684 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -137.63 73.76 1.45 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.979 0.418 . . . . 0.0 109.939 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.27 4.15 90.3 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.021 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 90.76 -95.18 2.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.401 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.0 mt . . . . . 0 C--O 1.243 0.749 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.583 178.586 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.433 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.878 0 N-CA-C 112.11 -0.396 . . . . 0.0 112.11 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.431 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 9.3 mp -57.68 -56.91 29.46 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 119.229 -0.415 . . . . 0.0 111.518 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.431 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 50.5 Cg_exo -42.37 -48.9 6.51 Favored 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 123.443 2.762 . . . . 0.0 113.369 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -62.78 -45.09 94.3 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.023 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.535 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 99.9 t -63.3 -36.15 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.422 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -71.2 -33.74 70.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 48.3 m -69.51 -20.6 63.71 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 122.373 1.082 . . . . 0.0 108.611 176.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.535 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 28.7 tp -75.95 -30.04 58.52 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.033 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 22.6 mmm-85 -66.21 -39.12 89.39 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.158 0.504 . . . . 0.0 110.319 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -70.24 -42.65 71.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.016 179.851 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 61.8 tt0 -65.55 -35.58 81.26 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.455 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.502 HG12 ' O ' ' B' ' 49' ' ' ARG . 5.4 p -76.52 -30.24 19.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.757 -178.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.86 -29.88 66.11 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -66.43 -56.3 11.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.454 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' C' ' 96' ' ' GLN . 27.3 tp -58.0 -34.47 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.039 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.442 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.4 tt0 -65.21 -45.09 86.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.571 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -60.07 -31.91 74.24 Favored Glycine 0 C--O 1.236 0.26 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.605 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.8 mt-30 -71.3 -44.01 65.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 110.681 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.0 t -67.35 -40.18 84.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 22.1 pt20 -63.2 -41.95 99.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.339 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.476 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.99 -18.11 54.23 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.676 -0.809 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 11.4 mt -71.14 -40.33 71.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.647 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -71.8 -31.77 66.91 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.7 -55.41 35.19 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.847 177.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.686 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.88 -40.91 97.02 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.636 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -54.73 -29.12 52.66 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.573 179.306 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.8 t -50.35 -27.76 6.81 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 111.109 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 52.6 mm-40 -95.41 -42.47 8.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.893 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.686 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 15.2 m-85 -74.06 -19.49 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 51.7 mtmt -71.11 -26.62 63.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.612 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -106.69 31.57 5.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.682 0.753 . . . . 0.0 109.666 178.509 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 3.0 t -93.44 -42.51 13.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.991 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 38.3 tt0 -96.86 100.7 12.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.229 1.014 . . . . 0.0 110.846 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.703 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -172.57 -30.29 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 112.653 -2.067 . . . . 0.0 109.795 179.727 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.755 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 39.2 m-85 -62.3 -55.63 38.23 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 177.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.755 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 89.1 Cg_endo -85.18 170.62 9.46 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.37 2.047 . . . . 0.0 111.442 179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -135.87 74.19 1.5 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.96 0.41 . . . . 0.0 110.227 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.36 6.13 89.49 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.98 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.75 -95.45 2.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.635 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.03 -0.986 . . . . 0.0 111.133 178.972 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.404 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.935 0 N-CA-C 112.049 -0.42 . . . . 0.0 112.049 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.439 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 9.1 mp -56.1 -56.36 31.75 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.772 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.439 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 51.6 Cg_exo -43.68 -46.97 10.0 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 123.119 2.546 . . . . 0.0 113.391 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.52 -45.13 88.58 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.137 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.588 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 96.0 t -63.02 -36.35 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.143 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.25 -34.52 70.83 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.723 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.2 m -69.23 -20.79 63.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.264 1.031 . . . . 0.0 108.312 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.789 ' O ' HG22 ' C' ' 92' ' ' VAL . 30.2 tp -74.64 -31.7 62.05 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.991 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.588 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 23.5 mmm-85 -64.87 -40.15 94.69 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.663 0.602 . . . . 0.0 110.524 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.723 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.83 -42.0 82.14 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 64.4 tt0 -64.76 -37.05 86.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.077 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.789 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -70.79 -38.82 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.603 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.35 -31.13 71.72 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -67.1 -57.54 6.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.792 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.493 ' O ' HG23 ' C' ' 99' ' ' VAL . 26.7 tp -57.83 -34.69 69.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.297 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.493 ' HA ' HD11 ' B' ' 55' ' ' LEU . 21.7 tt0 -65.23 -44.83 86.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.489 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.425 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.21 -31.55 73.73 Favored Glycine 0 C--O 1.238 0.388 0 N-CA-C 111.629 -0.588 . . . . 0.0 111.629 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 71.9 mt-30 -72.52 -43.65 63.27 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.643 -0.328 . . . . 0.0 110.532 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.493 HG23 ' O ' ' C' ' 95' ' ' LEU . 59.6 t -67.63 -40.11 83.49 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.425 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 3.7 pt20 -62.87 -42.37 99.74 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.313 -0.155 . . . . 0.0 111.12 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.51 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 6.6 p-80 -79.24 -17.32 54.99 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.966 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 11.0 mt -71.51 -40.73 69.96 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 177.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.19 -32.27 68.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.185 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.54 -54.95 41.01 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.936 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.692 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.28 -40.34 95.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.554 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.52 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -54.89 -29.32 55.47 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.473 179.028 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.8 t -49.64 -27.19 4.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.91 0.386 . . . . 0.0 111.298 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.432 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 52.3 mm-40 -96.16 -43.31 7.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.924 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.692 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 14.4 m-85 -73.38 -20.36 60.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.52 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 49.8 mtmt -70.74 -25.8 63.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.675 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.475 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -108.48 32.8 4.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.823 0.82 . . . . 0.0 109.516 178.147 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 3.0 t -93.79 -42.87 13.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.861 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.536 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 32.3 tt0 -96.73 99.55 11.14 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.35 1.072 . . . . 0.0 111.149 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.667 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -169.95 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 112.523 -2.126 . . . . 0.0 109.397 -179.731 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.763 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 41.2 m-85 -59.98 -57.51 26.23 Favored Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.214 178.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.763 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 90.2 Cg_endo -84.2 170.85 10.58 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.231 1.954 . . . . 0.0 111.829 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -136.04 73.5 1.46 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.97 0.414 . . . . 0.0 110.129 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.39 5.54 89.48 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.983 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 89.22 -94.69 2.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 18.9 mt . . . . . 0 C--O 1.243 0.761 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.289 179.031 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.527 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.834 0 N-CA-C 112.373 -0.291 . . . . 0.0 112.373 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.537 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 3.5 mm? -52.48 -56.83 18.95 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 8.3 Cg_endo -51.81 -37.42 65.61 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.229 2.619 . . . . 0.0 112.463 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.402 ' HA ' ' OG ' ' A' ' 7' ' ' SER . 31.1 m-20 -73.92 -7.15 51.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.549 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 1' ' ' GLY . 84.0 t -86.63 -42.06 15.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.778 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.88 -27.97 62.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.606 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 57.1 p -72.64 -19.63 61.41 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.481 HD11 HG11 ' B' ' 52' ' ' VAL . 57.9 tp -78.96 -24.13 44.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.354 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.778 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -65.82 -47.69 74.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.759 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.6 OUTLIER -65.37 -42.19 92.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.95 179.54 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -62.04 -34.32 76.02 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.374 0.607 . . . . 0.0 110.141 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.492 HG11 HD11 ' C' ' 88' ' ' LEU . 1.2 t -77.46 -31.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.299 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 51.5 mt-10 -66.88 -30.41 70.57 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -53.1 27.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.316 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 74.7 mt -58.8 -34.21 71.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.151 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.63 -46.86 74.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.502 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.537 ' HA2' ' NE2' ' A' ' 20' ' ' GLN . . . -60.06 -31.9 74.2 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.54 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.0 mt-30 -71.3 -46.88 59.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.839 0.352 . . . . 0.0 110.745 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' LEU . 89.5 t -64.46 -42.36 95.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.537 ' NE2' ' HA2' ' A' ' 17' ' ' GLY . 15.0 pt20 -62.36 -42.71 99.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.391 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.422 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 4.6 p-80 -78.01 -16.65 57.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.966 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.2 mt -72.0 -41.96 66.99 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.615 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -66.4 -36.12 82.04 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.369 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.46 -54.9 40.31 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.887 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.05 -41.86 93.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.367 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 4.3 m-85 -53.7 -32.17 50.85 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.646 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.9 t -49.71 -30.53 9.44 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.446 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 13.3 mm100 -91.62 -42.24 10.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.603 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.6 m-85 -73.33 -20.42 60.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.968 0.413 . . . . 0.0 111.37 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.534 ' HD2' ' O ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -63.23 -32.85 74.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.265 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -104.14 23.91 12.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.396 0.617 . . . . 0.0 110.548 178.444 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -93.74 -23.34 5.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.589 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' H ' ' A' ' 34' ' ' LEU . 72.8 tt0 -81.22 -126.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 31' ' ' LYS . 3.0 mt 62.45 -75.42 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.696 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 5.7 m-85 -53.7 -59.27 10.03 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.494 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.696 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 63.4 Cg_endo -78.13 176.12 10.33 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.953 1.769 . . . . 0.0 112.639 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -102.96 -89.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.476 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.467 ' HA3' ' HD3' ' C' ' 111' ' ' LYS . . . 103.36 18.38 14.89 Favored Glycine 0 C--N 1.329 0.191 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.632 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -107.06 -54.54 0.66 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.94 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.2 tt . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.191 179.548 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.517 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.983 0 N-CA-C 112.781 -0.128 . . . . 0.0 112.781 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.541 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 3.5 mm? -52.13 -56.69 19.61 Favored Pre-proline 0 N--CA 1.473 0.697 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 9.2 Cg_endo -52.05 -37.11 67.75 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.21 2.607 . . . . 0.0 112.505 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -74.13 -8.07 54.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.489 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 41' ' ' GLY . 86.8 t -85.7 -41.99 15.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.802 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.88 -27.1 61.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.882 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.68 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 49.6 p -73.92 -19.18 60.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.515 HD11 HG11 ' C' ' 92' ' ' VAL . 56.3 tp -78.89 -22.93 45.21 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.239 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.802 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -67.07 -47.66 70.61 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.7 OUTLIER -64.88 -43.07 94.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.774 179.326 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.23 -34.42 75.09 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.609 0.719 . . . . 0.0 110.395 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.481 HG11 HD11 ' A' ' 8' ' ' LEU . 1.1 t -78.08 -30.42 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.366 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 51.6 mt-10 -68.06 -29.52 68.51 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.08 21.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.9 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.495 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -58.56 -34.03 70.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.194 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -67.02 -46.89 73.1 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.655 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.54 ' HA2' ' NE2' ' B' ' 60' ' ' GLN . . . -59.89 -32.05 73.86 Favored Glycine 0 C--O 1.236 0.269 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.478 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 74.5 mt-30 -70.96 -47.55 58.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.764 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 55' ' ' LEU . 94.9 t -64.11 -41.85 93.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.54 ' NE2' ' HA2' ' B' ' 57' ' ' GLY . 14.5 pt20 -62.51 -43.31 99.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.412 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -77.31 -16.67 58.84 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.1 mt -72.01 -41.97 66.94 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.651 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.38 -36.48 82.96 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.615 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.17 -55.42 33.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.665 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.734 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.25 -42.07 90.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.51 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 4.3 m-85 -53.86 -32.7 53.99 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.658 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 47.7 t -48.17 -32.91 7.64 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.068 0.461 . . . . 0.0 111.054 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.448 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 12.8 mm100 -89.63 -41.86 11.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.871 0.367 . . . . 0.0 111.894 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.734 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 41.0 m-85 -72.76 -21.8 60.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.548 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.492 ' O ' ' HD2' ' B' ' 70' ' ' LYS . 0.4 OUTLIER -62.36 -33.63 75.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.187 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.571 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -103.47 23.61 12.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.465 0.65 . . . . 0.0 110.544 178.399 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -93.27 -23.29 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.485 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.489 ' O ' ' HD1' ' B' ' 75' ' ' PHE . 71.9 tt0 -81.28 -127.01 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.206 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.571 HD11 ' HA ' ' B' ' 71' ' ' LYS . 2.7 mt 62.07 -74.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 176.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.688 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 3.5 m-85 -54.24 -58.14 15.14 Favored Pre-proline 0 C--N 1.316 -0.857 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.647 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 66.5 Cg_endo -78.76 175.44 10.99 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.991 1.794 . . . . 0.0 112.726 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -102.57 -89.39 0.38 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' GLY . . . . . 0.491 ' HA3' ' HD3' ' A' ' 31' ' ' LYS . . . 103.94 18.79 12.95 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.865 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.66 -55.56 0.62 Allowed Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.788 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.8 tt . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.165 179.447 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.521 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.844 0 CA-C-O 120.508 -0.051 . . . . 0.0 113.182 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.529 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 3.5 mm? -51.77 -56.76 18.42 Favored Pre-proline 0 N--CA 1.468 0.425 0 C-N-CA 123.218 0.607 . . . . 0.0 112.618 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 6.9 Cg_endo -51.14 -39.45 61.15 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 123.37 2.714 . . . . 0.0 112.254 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -71.56 -10.63 60.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.517 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.521 HG23 ' O ' ' C' ' 81' ' ' GLY . 86.4 t -83.46 -42.28 17.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.818 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -73.1 -27.34 61.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.855 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 53.8 p -73.13 -19.26 61.17 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 12' ' ' VAL . 55.8 tp -79.19 -23.22 43.99 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.468 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.818 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.6 OUTLIER -66.67 -47.67 71.74 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.876 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.6 OUTLIER -65.23 -42.9 92.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.85 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -61.2 -34.94 75.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.5 0.667 . . . . 0.0 110.249 179.096 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.515 HG11 HD11 ' B' ' 48' ' ' LEU . 1.1 t -77.14 -30.88 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.389 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 53.0 mt-10 -68.1 -30.54 69.74 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.39 -53.1 32.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.172 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.509 ' O ' HG23 ' C' ' 99' ' ' VAL . 70.9 mt -59.02 -34.04 71.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.214 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -67.02 -46.68 73.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.691 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.517 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -60.08 -32.12 74.94 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.732 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 74.6 mt-30 -70.78 -47.58 58.8 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 120.886 0.374 . . . . 0.0 110.775 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.509 HG23 ' O ' ' C' ' 95' ' ' LEU . 87.8 t -64.01 -41.68 93.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.7 pt20 -63.16 -42.38 99.41 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.415 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 5.1 p-80 -78.14 -16.99 57.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.809 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 10.5 mt -71.35 -41.51 69.67 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.634 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -66.65 -36.8 83.43 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -55.68 -54.7 41.01 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.665 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.61 -42.07 96.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.393 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 4.4 m-85 -53.73 -31.75 49.48 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.655 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.5 t -49.77 -32.19 13.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.419 ' O ' ' HE3' ' C' ' 111' ' ' LYS . 13.1 mm100 -89.47 -43.16 11.04 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.642 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 38.0 m-85 -72.7 -20.76 61.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 111.409 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HD2' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -62.48 -29.54 70.61 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.467 ' HD3' ' HA3' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -106.22 19.88 19.83 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.074 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.679 HG22 ' O ' ' C' ' 109' ' ' TYR . 34.7 m -92.17 -19.14 7.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.312 177.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.584 ' O ' ' HD2' ' C' ' 116' ' ' PRO . 65.7 tt0 -76.46 -124.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 59.88 -84.85 0.02 OUTLIER 'General case' 0 C--N 1.338 0.098 0 CA-C-O 121.765 0.793 . . . . 0.0 112.6 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.714 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 2.8 m-85 -46.17 -60.7 3.26 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 113.588 -1.642 . . . . 0.0 113.432 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 70.3 Cg_endo -77.55 175.36 11.36 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.113 1.875 . . . . 0.0 112.847 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -102.74 -89.07 0.39 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.273 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 118' ' ' GLY . . . . . 0.433 ' HA3' ' HD3' ' B' ' 71' ' ' LYS . . . 103.36 17.95 16.15 Favored Glycine 0 C--N 1.329 0.194 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.593 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.12 -56.83 0.65 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.724 -0.751 . . . . 0.0 111.801 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 8.5 tt . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.251 -0.88 . . . . 0.0 109.842 179.36 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.459 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.851 -0.499 . . . . 0.0 111.851 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.475 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 6.9 mp -55.45 -55.41 40.3 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.69 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.475 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 50.6 Cg_exo -44.88 -43.29 15.24 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.94 2.427 . . . . 0.0 112.768 -179.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -62.92 -39.69 95.33 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.022 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 1' ' ' GLY . 60.3 t -59.67 -46.05 93.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.896 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.72 -26.67 62.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.967 0.413 . . . . 0.0 110.551 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 65.1 m -70.89 -19.29 62.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.851 0.834 . . . . 0.0 108.995 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.437 HD11 HG11 ' B' ' 52' ' ' VAL . 67.6 tp -76.64 -23.69 53.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.781 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 1.6 mmt85 -67.98 -32.63 73.18 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -70.87 -47.82 57.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.734 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.518 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 39.5 tt0 -63.25 -32.36 73.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.838 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.633 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.1 p -77.02 -32.52 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.109 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 44.0 mt-10 -70.78 -27.36 63.86 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.81 -53.69 20.17 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.48 -1.237 . . . . 0.0 109.288 178.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 77.0 mt -57.62 -33.33 68.13 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.384 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.457 ' HA ' HG12 ' A' ' 19' ' ' VAL . 17.8 tt0 -69.75 -44.35 70.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.8 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -60.99 -31.52 76.78 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.612 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -73.77 -46.83 43.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 16' ' ' GLN . 13.4 p -69.86 -31.09 46.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.749 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -71.42 -40.47 70.42 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.171 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.1 p-80 -79.77 -18.65 50.53 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.888 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.5 mt -73.37 -39.45 65.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.746 ' HG3' HD11 ' C' ' 102' ' ' LEU . 37.5 tt0 -65.99 -41.36 91.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.326 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.67 -46.79 74.1 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.263 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.713 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.81 -38.13 89.95 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.876 -1.057 . . . . 0.0 110.437 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.758 ' HB3' ' HG3' ' A' ' 30' ' ' LYS . 3.8 m-85 -59.24 -20.52 54.82 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.7 t -55.31 -23.68 24.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.099 0.476 . . . . 0.0 110.589 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.507 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 61.4 mm-40 -107.83 -20.85 13.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.015 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.713 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 27.8 m-85 -96.08 -17.25 21.05 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.758 ' HG3' ' HB3' ' A' ' 26' ' ' PHE . 73.6 mttt -68.42 -29.83 68.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.829 0.347 . . . . 0.0 110.351 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HD3' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -102.32 26.71 7.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.057 0.456 . . . . 0.0 110.303 178.222 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.664 HG23 ' HA ' ' A' ' 29' ' ' TYR . 5.1 t -87.37 -42.87 15.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.464 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 10.6 tt0 -99.86 105.35 17.09 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.224 1.012 . . . . 0.0 111.075 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.894 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -177.71 -36.22 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.471 0 CA-C-N 112.718 -2.037 . . . . 0.0 110.618 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.894 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -121.82 -0.3 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.233 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 179.563 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.665 ' HD3' ' H ' ' A' ' 35' ' ' PHE . 31.9 Cg_exo -65.51 -172.39 0.24 Allowed 'Trans proline' 0 C--N 1.371 1.749 0 CA-C-N 122.468 1.917 . . . . 0.0 114.268 -178.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.454 ' OD1' ' HA ' ' C' ' 116' ' ' PRO . 17.7 p-10 -100.32 -161.79 0.89 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.955 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 144.86 -157.19 27.22 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.092 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -110.63 66.61 0.23 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.529 -0.844 . . . . 0.0 111.776 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.723 -179.368 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.437 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.815 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.497 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 6.8 mp -55.96 -55.6 39.56 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-O 119.11 -0.471 . . . . 0.0 112.026 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.497 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 53.6 Cg_exo -44.45 -43.78 13.71 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.735 2.29 . . . . 0.0 112.77 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -62.41 -39.66 94.0 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.066 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.437 HG23 ' O ' ' B' ' 41' ' ' GLY . 57.4 t -59.94 -45.49 95.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.992 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.21 -26.11 61.91 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.53 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.6 m -71.09 -18.94 62.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.873 0.844 . . . . 0.0 108.982 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.431 HD11 HG11 ' C' ' 92' ' ' VAL . 69.8 tp -76.98 -23.76 52.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.877 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 1.7 mmt85 -67.99 -32.57 73.06 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.517 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.1 OUTLIER -70.84 -49.11 49.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.747 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' B' ' 55' ' ' LEU . 39.7 tt0 -62.42 -31.69 72.43 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -77.56 -32.35 18.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.265 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 44.1 mt-10 -70.9 -27.67 63.96 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.35 -53.98 20.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.258 178.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 78.5 mt -57.87 -32.6 67.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.372 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.432 ' HA ' HG12 ' B' ' 59' ' ' VAL . 16.7 tt0 -70.41 -44.83 67.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.688 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.0 -31.12 75.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.476 179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.5 OUTLIER -73.72 -46.56 45.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.729 0.3 . . . . 0.0 111.489 179.37 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' B' ' 56' ' ' GLN . 13.2 p -70.21 -30.94 45.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.641 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 19.1 pt20 -71.42 -40.86 70.18 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.828 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.531 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.0 p-80 -79.34 -19.11 51.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.656 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.9 mt -73.25 -39.72 65.2 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.564 ' HG3' HD21 ' A' ' 22' ' ' LEU . 37.7 tt0 -65.35 -42.18 93.1 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.1 -46.75 72.17 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.46 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.727 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.393 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.752 ' HB3' ' HG3' ' B' ' 70' ' ' LYS . 3.6 m-85 -58.49 -20.91 49.52 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 39.9 t -54.12 -25.61 23.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.054 0.454 . . . . 0.0 110.495 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.542 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 57.9 mm-40 -106.51 -20.91 13.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.2 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.727 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 26.7 m-85 -95.75 -17.56 21.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' B' ' 66' ' ' PHE . 73.4 mttt -68.27 -30.24 69.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.076 0.465 . . . . 0.0 110.632 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.488 ' HE3' ' HB2' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -101.88 26.61 7.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.298 0.571 . . . . 0.0 110.465 178.426 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.633 HG23 ' HA ' ' B' ' 69' ' ' TYR . 5.0 t -87.63 -42.44 15.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.645 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.507 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 12.4 tt0 -100.62 103.66 14.96 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 122.13 0.967 . . . . 0.0 111.339 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.83 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -176.28 -33.13 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 112.68 -2.055 . . . . 0.0 110.822 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.83 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.1 OUTLIER -124.47 0.32 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.164 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.716 ' HD3' ' H ' ' B' ' 75' ' ' PHE . 37.6 Cg_exo -65.63 -172.11 0.23 Allowed 'Trans proline' 0 C--N 1.369 1.63 0 CA-C-N 122.372 1.883 . . . . 0.0 114.476 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ASN . . . . . 0.541 ' OD1' ' HA ' ' A' ' 36' ' ' PRO . 17.1 p-10 -100.47 -161.35 0.86 Allowed 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 114.358 -1.292 . . . . 0.0 110.997 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.61 -160.43 27.68 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.037 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -108.66 69.14 0.21 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.248 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 7.9 tp . . . . . 0 C--O 1.244 0.796 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.602 -179.63 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.457 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.852 0 N-CA-C 111.838 -0.505 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.487 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 6.8 mp -56.54 -54.98 47.68 Favored Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 117.014 0.407 . . . . 0.0 111.656 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.487 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 51.5 Cg_exo -44.44 -42.95 14.02 Favored 'Trans proline' 0 C--N 1.363 1.308 0 C-N-CA 122.712 2.275 . . . . 0.0 112.881 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -63.85 -40.04 95.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.027 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.457 HG23 ' O ' ' C' ' 81' ' ' GLY . 64.8 t -58.95 -46.72 91.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.916 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.51 -26.05 62.51 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.001 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.526 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 67.2 m -71.82 -18.5 62.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.893 0.854 . . . . 0.0 108.849 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.467 HD11 HG11 ' A' ' 12' ' ' VAL . 65.6 tp -77.08 -23.25 51.93 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.634 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.645 ' O ' HG12 ' C' ' 92' ' ' VAL . 1.9 mmt85 -67.99 -32.51 72.96 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -71.29 -48.14 52.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.026 179.676 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.541 ' O ' ' HG ' ' C' ' 95' ' ' LEU . 38.7 tt0 -63.3 -31.77 73.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.583 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.645 HG12 ' O ' ' C' ' 89' ' ' ARG . 1.1 p -77.29 -32.7 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.263 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 43.9 mt-10 -70.95 -26.26 63.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.79 18.14 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.173 178.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' C' ' 91' ' ' GLN . 75.5 mt -57.91 -32.77 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.423 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.439 ' O ' ' HG2' ' C' ' 100' ' ' GLN . 16.9 tt0 -69.68 -44.84 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.623 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.472 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.61 -31.3 74.51 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.748 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.623 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 0.5 OUTLIER -74.72 -44.94 47.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.692 0.282 . . . . 0.0 111.509 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' C' ' 96' ' ' GLN . 13.5 p -71.34 -30.51 40.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.453 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.472 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.2 pt20 -71.64 -42.2 67.89 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.157 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.623 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 10.5 p-80 -77.48 -19.03 56.54 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.902 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.746 HD11 ' HG3' ' A' ' 23' ' ' GLN . 1.5 mp -73.89 -39.45 63.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.532 ' HG3' HD21 ' B' ' 62' ' ' LEU . 38.2 tt0 -66.62 -41.46 88.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.03 71.72 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.421 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.739 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.33 -39.07 93.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.455 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.756 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 3.5 m-85 -58.58 -20.28 45.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.4 t -54.6 -25.67 27.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.212 0.529 . . . . 0.0 110.245 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' C' ' 111' ' ' LYS . 60.4 mm-40 -105.54 -22.82 12.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.085 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.739 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 25.8 m-85 -93.75 -17.83 22.73 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.756 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 74.2 mttt -68.01 -28.54 67.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.021 0.439 . . . . 0.0 110.619 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.05 26.52 8.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.223 0.535 . . . . 0.0 110.327 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' C' ' 109' ' ' TYR . 4.6 t -87.09 -42.66 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.214 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.542 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 7.4 tt0 -99.95 104.77 16.42 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 122.043 0.925 . . . . 0.0 111.342 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.852 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -177.74 -33.81 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 112.964 -1.926 . . . . 0.0 111.034 -179.648 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.852 ' H ' HD23 ' C' ' 114' ' ' LEU . 0.1 OUTLIER -124.09 0.6 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.167 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.709 ' HD3' ' H ' ' C' ' 115' ' ' PHE . 42.2 Cg_exo -65.52 -168.46 0.12 Allowed 'Trans proline' 0 C--N 1.37 1.675 0 CA-C-N 122.337 1.871 . . . . 0.0 114.183 -178.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 117' ' ' ASN . . . . . 0.486 ' OD1' ' HA ' ' B' ' 76' ' ' PRO . 17.1 p-10 -104.62 -162.13 0.87 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.856 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 146.19 -155.53 26.56 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -113.72 67.09 0.26 Allowed Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.516 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.463 -0.779 . . . . 0.0 110.424 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.437 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 2.01 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.534 ' HB3' ' HD3' ' A' ' 3' ' ' PRO . 2.3 tm? -63.82 -53.11 52.51 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 122.756 0.422 . . . . 0.0 110.787 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 2' ' ' LEU . 71.6 Cg_exo -43.89 -44.97 11.69 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.914 2.41 . . . . 0.0 113.213 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.45 -32.18 73.55 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.938 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.701 HG22 HG11 ' B' ' 45' ' ' VAL . 82.7 t -63.01 -44.18 99.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.064 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -66.68 -37.52 84.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.785 0.326 . . . . 0.0 110.521 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.716 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 41.1 m -63.32 -26.35 68.72 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.834 0.826 . . . . 0.0 109.154 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 12' ' ' VAL . 62.5 tp -74.21 -39.87 62.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.255 178.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -55.86 -44.4 78.03 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.716 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -63.8 -42.15 97.76 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.757 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.7 tt0 -63.22 -34.8 78.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.989 0.423 . . . . 0.0 110.738 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 8' ' ' LEU . 54.5 t -70.07 -40.63 78.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.577 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 32.5 tt0 -63.3 -32.02 73.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.49 -61.42 2.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.549 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.7 mm? -60.27 -31.41 70.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.485 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.547 ' HA ' HG12 ' A' ' 19' ' ' VAL . 14.4 pt20 -74.16 -28.61 61.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -67.0 -33.55 84.16 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.72 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.9 mm100 -71.09 -50.5 33.1 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.334 -0.433 . . . . 0.0 111.102 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.547 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.4 p -66.8 -33.52 63.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.362 -0.535 . . . . 0.0 111.995 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.58 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -66.11 -43.17 87.99 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.96 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -76.97 -19.71 56.99 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.208 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.771 HD21 ' HG2' ' B' ' 63' ' ' GLN . 24.6 mt -71.01 -42.72 69.22 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' C' ' 102' ' ' LEU . 5.8 tm0? -70.19 -33.49 71.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.89 -62.46 1.73 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.48 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.709 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.85 -42.61 98.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.863 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.74 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -57.0 -25.98 59.45 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.705 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -53.75 -28.59 35.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.267 0.556 . . . . 0.0 110.207 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 54.5 mt-30 -90.75 -50.29 5.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.893 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.709 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 19.5 m-85 -66.58 -17.81 65.02 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -70.86 -20.71 62.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 110.782 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.56 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.25 35.52 3.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.592 0.71 . . . . 0.0 109.495 178.333 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 29' ' ' TYR . 15.5 t -98.65 -35.64 5.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.805 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.549 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 40.3 tt0 -88.19 89.76 8.12 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 122.861 1.315 . . . . 0.0 110.934 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.632 HD12 ' H ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -167.92 -36.66 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 111.983 -2.371 . . . . 0.0 109.068 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.715 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 59.2 m-85 -56.51 -55.55 41.56 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.291 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.715 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 93.3 Cg_endo -82.73 178.61 5.93 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.248 1.965 . . . . 0.0 111.241 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -89.3 -55.75 3.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.749 0.309 . . . . 0.0 111.47 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.66 -108.58 3.07 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.845 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.78 -63.98 4.38 Favored Glycine 0 C--N 1.328 0.094 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.676 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.73 -0.652 . . . . 0.0 111.143 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.441 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.545 ' HB3' ' HD3' ' B' ' 43' ' ' PRO . 2.4 tm? -63.79 -53.32 51.03 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.733 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' B' ' 42' ' ' LEU . 77.2 Cg_exo -43.67 -45.34 10.91 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 122.626 2.217 . . . . 0.0 113.242 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.06 -31.03 72.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.232 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.701 HG11 HG22 ' A' ' 5' ' ' VAL . 83.7 t -64.05 -44.43 97.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.942 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.678 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.34 -38.38 87.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.667 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.0 m -63.8 -23.91 67.55 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.803 0.811 . . . . 0.0 109.548 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.795 ' O ' HG23 ' B' ' 52' ' ' VAL . 65.0 tp -76.04 -39.35 55.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.678 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -56.01 -44.2 78.45 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -64.21 -42.88 96.41 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.565 179.575 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.0 tt0 -62.04 -35.08 77.53 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.034 0.445 . . . . 0.0 110.787 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.795 HG23 ' O ' ' B' ' 48' ' ' LEU . 57.9 t -70.44 -40.11 77.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.607 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 32.9 tt0 -63.39 -32.05 73.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.8 0.809 . . . . 0.0 109.006 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.53 -61.19 2.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.588 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' B' ' 55' ' ' LEU . 2.6 mm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.353 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.532 ' HA ' HG12 ' B' ' 59' ' ' VAL . 14.1 pt20 -73.94 -28.78 61.68 Favored 'General case' 0 C--O 1.222 -0.395 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.577 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -67.25 -33.25 82.14 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 119.909 -1.138 . . . . 0.0 110.506 178.256 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.723 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.8 mm-40 -71.42 -49.66 39.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.547 -0.326 . . . . 0.0 111.263 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.8 p -67.56 -33.06 59.85 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.959 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -66.06 -44.36 84.78 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.899 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -76.01 -19.93 58.25 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.408 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 23.0 mt -71.28 -42.31 68.9 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.771 ' HG2' HD21 ' A' ' 22' ' ' LEU . 5.8 tm0? -69.98 -34.67 73.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.3 -61.94 2.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.459 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.68 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.16 -42.78 99.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.666 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.745 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.67 -26.15 55.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.195 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.9 t -54.1 -27.9 35.89 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.272 0.558 . . . . 0.0 110.325 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 55.8 mt-30 -90.87 -51.0 5.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.592 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.68 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 17.4 m-85 -65.72 -17.83 64.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -71.41 -20.64 62.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.979 0.419 . . . . 0.0 110.756 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.556 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -107.17 36.07 2.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.135 0.969 . . . . 0.0 109.181 178.074 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.495 HG23 ' HA ' ' B' ' 69' ' ' TYR . 15.6 t -99.56 -35.01 4.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.72 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 46.5 tt0 -88.85 89.12 7.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 122.869 1.319 . . . . 0.0 111.029 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.639 HD12 ' H ' ' B' ' 75' ' ' PHE . 0.2 OUTLIER -167.72 -36.06 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 111.713 -2.494 . . . . 0.0 109.256 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.709 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 57.5 m-85 -56.9 -55.48 43.22 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.327 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 87.5 Cg_endo -82.15 -177.82 3.72 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 122.273 1.982 . . . . 0.0 111.194 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -92.89 -56.26 3.06 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.114 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 84.35 -107.62 3.02 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.613 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.74 -64.69 4.26 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.705 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.1 pp . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.5 -179.858 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.12 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.496 ' HB3' ' HD3' ' C' ' 83' ' ' PRO . 6.8 tp -63.61 -52.18 60.94 Favored Pre-proline 0 N--CA 1.445 -0.691 0 CA-C-N 117.431 0.615 . . . . 0.0 112.399 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' C' ' 82' ' ' LEU . 73.1 Cg_exo -43.06 -44.2 9.57 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.675 2.25 . . . . 0.0 112.67 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.98 -32.59 73.96 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.063 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.668 HG22 HG11 ' A' ' 5' ' ' VAL . 89.5 t -62.9 -44.48 99.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.118 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.609 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -66.81 -38.35 86.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.401 . . . . 0.0 110.166 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 20.9 m -62.78 -26.31 68.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.883 0.849 . . . . 0.0 109.287 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.691 ' O ' HG12 ' C' ' 92' ' ' VAL . 63.5 tp -73.09 -42.1 63.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.004 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.675 HH11 ' HB3' ' C' ' 89' ' ' ARG . 0.0 OUTLIER -55.82 -43.82 77.31 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.952 0.342 . . . . 0.0 110.637 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -63.48 -41.74 98.57 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.031 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -63.0 -36.77 84.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.953 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.691 HG12 ' O ' ' C' ' 88' ' ' LEU . 0.2 OUTLIER -74.8 -31.29 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.398 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.581 -179.48 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.535 ' O ' ' HG2' ' C' ' 96' ' ' GLN . 36.7 tt0 -65.34 -33.49 76.09 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.51 -58.85 4.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.657 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.3 mm? -60.97 -31.08 70.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.07 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' C' ' 99' ' ' VAL . 14.5 pt20 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.588 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -66.63 -34.11 86.51 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.157 -1.02 . . . . 0.0 110.619 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.5 mm-40 -70.62 -49.43 47.65 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.367 -0.416 . . . . 0.0 111.089 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.7 p -68.08 -32.74 57.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 C-N-CA 120.342 -0.543 . . . . 0.0 112.194 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.86 -43.21 84.2 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.681 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -76.87 -19.69 57.17 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.013 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 23.6 mt -71.55 -41.95 68.45 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.7 ' HG2' HD21 ' B' ' 62' ' ' LEU . 6.3 tm0? -70.69 -34.21 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.39 -62.4 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.472 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.46 -42.49 96.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.664 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.705 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -56.27 -28.26 58.02 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.705 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.8 t -51.19 -29.93 15.49 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.133 0.492 . . . . 0.0 110.314 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.549 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 52.7 mt-30 -89.82 -51.33 5.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.047 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 19.3 m-85 -66.34 -17.27 64.67 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -177.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.47 -19.37 62.22 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.984 0.421 . . . . 0.0 110.875 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.491 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -109.08 35.7 3.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.812 0.815 . . . . 0.0 109.29 177.677 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.523 HG23 ' HA ' ' C' ' 109' ' ' TYR . 16.2 t -98.28 -36.08 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.835 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 43.1 tt0 -87.32 89.51 8.02 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.958 1.361 . . . . 0.0 111.039 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.633 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -167.39 -37.54 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.071 -2.331 . . . . 0.0 109.202 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.686 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 58.9 m-85 -56.03 -55.89 36.68 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.243 178.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.686 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 90.3 Cg_endo -81.85 -179.47 4.84 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.089 1.859 . . . . 0.0 111.286 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -91.18 -55.8 3.4 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.912 0.387 . . . . 0.0 111.283 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.95 -107.37 2.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.889 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 81.99 -65.59 4.03 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.621 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.61 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.512 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.04 -0.424 . . . . 0.0 112.04 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.557 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 3.3 mm? -56.05 -55.11 45.15 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 2.3 Cg_endo -50.62 -41.13 54.54 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.258 2.639 . . . . 0.0 112.624 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.24 -34.5 77.81 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.581 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 1' ' ' GLY . 96.7 t -61.14 -55.38 25.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.955 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.81 -33.46 75.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.112 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.4 m -66.95 -28.71 68.51 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.645 0.735 . . . . 0.0 109.792 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 70.0 tp -73.28 -22.34 60.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.09 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 12' ' ' VAL . 25.8 mmm-85 -69.13 -23.59 63.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.3 OUTLIER -75.34 -40.2 58.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -72.07 -29.29 63.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.841 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.727 HG22 ' HA ' ' A' ' 9' ' ' ARG . 27.6 m -76.05 -38.71 35.6 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.296 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 95.7 mt-10 -70.06 -28.84 65.77 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.65 -60.85 2.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.015 177.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.0 mm? -58.3 -39.43 79.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 17.0 pt20 -67.13 -28.1 67.86 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.738 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.664 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -66.66 -33.42 84.36 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.74 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 82.3 mt-30 -72.05 -40.42 68.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.718 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' LEU . 2.6 t -67.65 -39.9 83.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.963 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.664 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.2 pt20 -62.18 -42.18 99.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.926 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 5.9 p-80 -81.66 -16.79 50.24 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.44 -0.904 . . . . 0.0 111.56 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.74 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -74.01 -43.6 57.43 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.576 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.7 tm0? -68.07 -36.22 79.49 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.64 70.88 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.159 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.33 -43.91 95.99 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.581 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.649 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 1.8 m-85 -52.28 -30.17 26.68 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.489 0.493 . . . . 0.0 111.953 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.5 t -50.69 -31.92 17.81 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.984 0.421 . . . . 0.0 111.142 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.442 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 97.1 mm-40 -89.57 -44.62 9.96 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.8 m-85 -65.21 -20.02 66.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.867 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.3 -26.11 60.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.526 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.23 32.39 4.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.012 0.91 . . . . 0.0 109.453 178.013 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.735 HG11 HG12 ' B' ' 72' ' ' VAL . 65.7 t -128.13 -24.48 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.55 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.855 ' HG3' ' H ' ' A' ' 34' ' ' LEU . 3.5 pt-20 -65.18 -63.8 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.718 0.77 . . . . 0.0 112.361 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.855 ' H ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -46.4 -49.21 18.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.53 -1.668 . . . . 0.0 115.107 -177.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.619 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 21.4 m-30 -47.09 -68.03 0.34 Allowed Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.694 ' HG2' HG22 ' C' ' 112' ' ' VAL . 19.1 Cg_endo -64.51 176.82 2.51 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.516 2.144 . . . . 0.0 113.937 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -165.21 153.1 11.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.046 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.74 133.02 34.81 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.447 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -170.67 -110.36 0.23 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.082 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.4 tp . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.406 -0.806 . . . . 0.0 110.431 -179.916 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.511 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.986 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.548 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 3.3 mm? -56.53 -54.8 49.53 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 2.7 Cg_endo -50.93 -40.14 58.48 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.166 2.578 . . . . 0.0 112.661 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.37 -36.67 84.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.333 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.511 HG23 ' O ' ' B' ' 41' ' ' GLY . 96.4 t -59.07 -55.05 26.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.092 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.521 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.1 -33.71 76.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.327 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.9 m -67.17 -28.07 67.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.688 0.756 . . . . 0.0 109.594 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 tp -73.15 -23.03 60.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.101 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.737 ' HA ' HG22 ' B' ' 52' ' ' VAL . 24.1 mmm-85 -69.07 -23.16 64.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.5 OUTLIER -74.99 -40.53 60.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.596 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -72.01 -29.12 63.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.872 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.737 HG22 ' HA ' ' B' ' 49' ' ' ARG . 27.2 m -76.4 -38.59 32.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.206 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 92.6 mt-10 -70.34 -28.06 64.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.79 -60.72 2.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.196 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.584 HD12 HG11 ' C' ' 99' ' ' VAL . 2.1 mm? -58.26 -39.59 79.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.005 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.7 pt20 -66.92 -28.45 68.31 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.398 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -66.15 -33.65 85.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.713 178.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 82.4 mt-30 -71.78 -40.37 69.3 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.497 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' O ' ' B' ' 55' ' ' LEU . 2.5 t -67.99 -39.84 82.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.064 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.3 pt20 -61.53 -42.48 98.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.83 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 5.9 p-80 -81.51 -17.77 47.42 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.447 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 6.5 mt -72.73 -43.7 62.64 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -68.36 -36.54 79.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.99 -50.63 70.31 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.589 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.737 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.36 -43.83 96.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.394 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.598 ' HA ' ' HD2' ' B' ' 69' ' ' TYR . 1.5 m-85 -51.48 -30.67 20.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.692 0.62 . . . . 0.0 111.854 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 40.6 t -49.82 -33.47 16.81 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.837 0.351 . . . . 0.0 111.106 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' B' ' 71' ' ' LYS . 97.4 mm-40 -88.68 -44.4 10.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.492 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.737 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 46.1 m-85 -64.86 -20.5 66.45 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.771 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -57.47 -27.21 62.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.234 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -105.01 31.97 4.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.083 0.944 . . . . 0.0 109.351 178.34 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.735 HG12 HG11 ' A' ' 32' ' ' VAL . 64.6 t -127.83 -24.8 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.257 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.871 ' HG3' ' H ' ' B' ' 74' ' ' LEU . 3.4 pt-20 -64.44 -64.53 0.86 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.663 0.744 . . . . 0.0 112.191 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.871 ' H ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -45.62 -50.53 13.21 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 125.987 1.715 . . . . 0.0 115.271 -177.861 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.628 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 21.1 m-30 -46.39 -68.12 0.33 Allowed Pre-proline 0 N--CA 1.477 0.913 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.69 ' HG2' HG22 ' A' ' 32' ' ' VAL . 19.3 Cg_endo -64.23 177.72 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.598 2.198 . . . . 0.0 113.699 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -167.26 152.85 7.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.988 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.18 133.68 36.5 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.635 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.05 -110.04 0.23 Allowed Glycine 0 CA--C 1.51 -0.253 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.13 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 tp . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.013 179.554 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.511 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.569 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 3.3 mm? -56.24 -55.9 37.13 Favored Pre-proline 0 N--CA 1.468 0.427 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 5.3 Cg_endo -50.18 -40.67 51.26 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.538 2.825 . . . . 0.0 112.673 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -63.4 -34.72 78.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.446 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.511 HG23 ' O ' ' C' ' 81' ' ' GLY . 85.2 t -61.28 -54.86 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.982 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.76 -33.05 75.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.73 0.3 . . . . 0.0 111.129 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.7 m -66.86 -29.05 68.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.652 0.739 . . . . 0.0 109.489 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.438 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 70.2 tp -72.7 -22.77 60.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.86 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 31.2 mmm-85 -66.32 -27.46 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.3 OUTLIER -73.02 -42.16 63.48 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.905 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.83 -27.37 63.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.662 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 0.8 OUTLIER -76.16 -42.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.314 -178.374 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.578 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 94.2 mt-10 -70.97 -27.16 63.53 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.76 -61.08 2.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.257 -1.338 . . . . 0.0 110.079 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.557 ' O ' HG12 ' C' ' 99' ' ' VAL . 1.6 mm? -58.09 -37.97 75.52 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.95 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.578 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 16.5 pt20 -69.13 -27.74 65.84 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.611 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.672 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -66.63 -33.44 84.47 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 178.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.45 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 83.5 mt-30 -72.52 -41.93 65.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.403 -0.399 . . . . 0.0 111.181 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.584 HG11 HD12 ' B' ' 55' ' ' LEU . 0.2 OUTLIER -72.38 -30.14 33.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.828 -179.399 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.672 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.0 pt20 -66.6 -43.33 85.15 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.106 -0.237 . . . . 0.0 110.503 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.45 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 8.3 p-80 -79.9 -16.67 54.88 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 119.939 -0.705 . . . . 0.0 111.433 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.649 ' HG ' ' CE2' ' A' ' 26' ' ' PHE . 1.3 mp -75.2 -42.39 55.72 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.09 -50.67 70.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.673 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.21 -43.88 95.59 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.357 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.584 ' HA ' ' HD2' ' C' ' 109' ' ' TYR . 1.6 m-85 -52.14 -30.42 26.46 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.942 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.9 t -49.94 -33.78 18.6 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.979 0.419 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.414 ' O ' ' HE2' ' C' ' 111' ' ' LYS . 97.1 mm-40 -87.46 -45.85 10.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.728 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 43.5 m-85 -64.28 -20.53 66.13 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.933 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -56.2 -28.0 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -105.23 32.07 4.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.947 0.879 . . . . 0.0 109.758 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.737 HG21 ' HA ' ' A' ' 33' ' ' GLU . 59.8 t -128.04 -23.96 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.2 -1.363 . . . . 0.0 110.479 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.807 ' HG3' ' H ' ' C' ' 114' ' ' LEU . 3.6 pt-20 -66.49 -60.44 2.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.875 0.845 . . . . 0.0 112.879 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.807 ' H ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -50.69 -46.35 58.7 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 113.859 -1.519 . . . . 0.0 115.04 -177.282 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.57 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 21.3 m-30 -48.7 -67.58 0.41 Allowed Pre-proline 0 N--CA 1.473 0.707 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 -177.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.651 ' HG2' HG22 ' B' ' 72' ' ' VAL . 25.9 Cg_endo -65.61 176.89 3.12 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.522 2.148 . . . . 0.0 113.92 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -165.6 153.81 11.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.105 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -66.91 134.18 31.94 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.568 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -171.36 -111.12 0.25 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 C--O 1.248 0.977 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.873 179.104 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.421 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.911 0 CA-C-O 120.024 -0.32 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.586 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 6.7 mp -58.41 -56.84 31.28 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 119.255 -0.402 . . . . 0.0 111.381 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 81.6 Cg_exo -43.44 -45.49 10.28 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.879 2.386 . . . . 0.0 112.947 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.89 -41.76 92.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.207 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 1' ' ' GLY . 97.8 t -60.97 -51.31 74.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.799 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.44 -33.25 74.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.084 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.739 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 7.9 t -68.14 -20.8 64.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.673 HD11 HG21 ' B' ' 52' ' ' VAL . 59.2 tp -76.2 -28.14 57.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.152 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.642 ' HE ' HD13 ' C' ' 88' ' ' LEU . 23.6 mmm-85 -62.91 -43.67 98.16 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.739 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.49 -37.09 82.33 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.566 178.806 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' SER . 84.7 mt-30 -63.33 -33.77 76.26 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 121.529 0.68 . . . . 0.0 109.469 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.677 HG21 HD11 ' C' ' 88' ' ' LEU . 54.1 t -72.11 -35.08 52.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.469 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 97.7 mt-10 -66.35 -26.2 67.17 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.387 0.613 . . . . 0.0 109.545 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -69.43 -53.15 20.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.221 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.638 HD11 ' HA ' ' B' ' 56' ' ' GLN . 4.0 mm? -56.52 -35.31 67.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.461 178.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.649 ' HA ' HD11 ' C' ' 95' ' ' LEU . 21.6 tt0 -71.3 -43.43 67.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.152 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.59 -31.83 76.22 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.871 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.579 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 58.9 mt-30 -75.27 -41.92 56.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.829 0.347 . . . . 0.0 111.167 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.4 p -73.95 -27.4 22.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.59 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 17.8 pt20 -74.11 -40.01 62.97 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.571 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.3 p-80 -80.95 -19.9 43.17 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.602 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.724 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.8 mp -79.85 -33.99 39.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.642 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.701 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.4 tm0? -74.46 -30.2 61.77 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.3 -62.68 1.7 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.775 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -58.41 -43.29 88.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.371 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.62 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -53.86 -32.06 51.75 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.074 -179.636 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.5 t -50.51 -33.92 23.3 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.712 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 34.7 mt-30 -82.7 -46.78 12.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.236 0.541 . . . . 0.0 110.981 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.66 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 24.9 m-85 -71.29 -18.86 62.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.098 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' A' ' 30' ' ' LYS . 14.2 tmtt? -72.91 -25.71 61.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.752 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.712 ' HE2' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.73 29.49 6.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.724 0.773 . . . . 0.0 109.347 177.014 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.623 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 8.8 t -95.27 -36.79 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.01 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.55 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 14.1 tt0 -95.2 101.05 12.77 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.744 1.259 . . . . 0.0 111.11 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.59 HD12 ' H ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -164.04 -39.9 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 112.738 -2.028 . . . . 0.0 109.365 -179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.919 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 36.7 m-85 -66.63 -62.1 4.34 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.068 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.919 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 33.1 Cg_endo -91.64 -177.22 0.94 Allowed 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.955 2.436 . . . . 0.0 113.002 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -129.33 106.63 8.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.402 178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.83 140.86 18.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.432 -0.89 . . . . 0.0 112.648 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 103.73 -48.15 1.04 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.71 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 26.9 mt . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.514 -179.559 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.454 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.834 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.603 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 6.9 mp -59.07 -58.13 21.83 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 119.439 -0.315 . . . . 0.0 111.054 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 73.0 Cg_exo -41.55 -46.53 6.08 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 123.517 2.811 . . . . 0.0 113.273 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.26 -42.85 96.2 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.864 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.454 HG23 ' O ' ' B' ' 41' ' ' GLY . 95.5 t -59.66 -51.0 77.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.729 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.56 -33.1 74.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.75 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 8.2 t -68.81 -20.29 64.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.528 0.68 . . . . 0.0 109.277 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.707 HD11 HG21 ' C' ' 92' ' ' VAL . 59.4 tp -76.0 -28.51 57.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.139 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.671 ' HE ' HD13 ' A' ' 8' ' ' LEU . 23.6 mmm-85 -62.88 -43.76 97.92 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.75 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -67.73 -36.59 80.86 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.649 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 47' ' ' SER . 86.1 mt-30 -63.46 -33.54 75.78 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.547 0.689 . . . . 0.0 109.325 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.673 HG21 HD11 ' A' ' 8' ' ' LEU . 63.1 t -73.05 -34.68 46.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.128 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 96.7 mt-10 -66.17 -25.71 67.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.494 0.664 . . . . 0.0 109.241 178.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.06 -52.91 20.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.679 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.635 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.24 -34.82 68.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.265 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.638 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.5 tt0 -71.48 -43.14 67.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.216 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.419 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -60.6 -32.37 78.1 Favored Glycine 0 C--N 1.319 -0.415 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.592 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.583 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 58.9 mt-30 -74.89 -41.63 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.824 0.345 . . . . 0.0 111.418 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.486 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.1 p -74.14 -26.73 21.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.586 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.419 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 17.2 pt20 -74.46 -40.8 61.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.563 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.583 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.5 p-80 -80.16 -19.89 46.12 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.665 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' C' ' 103' ' ' GLN . 1.8 mp -79.51 -34.16 41.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.23 -0.588 . . . . 0.0 109.644 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.724 ' HG2' HD11 ' A' ' 22' ' ' LEU . 4.8 tm0? -74.34 -30.63 62.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.9 -63.17 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.025 -1.443 . . . . 0.0 109.751 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.641 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -57.24 -43.7 83.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.225 178.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.633 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -53.64 -32.64 52.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.012 -179.613 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.7 t -50.41 -32.58 18.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.855 0.36 . . . . 0.0 110.999 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.753 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 32.3 mt-30 -84.31 -46.65 11.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.171 0.51 . . . . 0.0 110.883 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.641 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 22.8 m-85 -70.88 -19.11 62.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.031 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' B' ' 70' ' ' LYS . 14.0 tmtt? -73.04 -24.78 60.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.981 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -107.53 29.65 7.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.952 0.882 . . . . 0.0 109.45 176.814 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.62 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 8.1 t -95.24 -37.56 7.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.107 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.534 ' C ' ' HG ' ' B' ' 74' ' ' LEU . 14.2 tt0 -95.11 99.94 11.84 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 111.06 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 75' ' ' PHE . 0.1 OUTLIER -162.2 -41.27 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.826 179.804 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.936 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 34.8 m-85 -64.83 -62.5 4.79 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.425 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.936 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 41.5 Cg_endo -91.12 -174.39 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.912 2.408 . . . . 0.0 112.641 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -132.6 105.43 7.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.378 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.06 141.18 19.09 Favored Glycine 0 CA--C 1.511 -0.191 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.805 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 104.28 -48.24 1.01 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.653 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 25.5 mt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.598 -0.715 . . . . 0.0 109.969 179.868 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.429 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.936 0 N-CA-C 112.29 -0.324 . . . . 0.0 112.29 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.611 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 6.8 mp -59.24 -56.7 33.41 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.281 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 75.2 Cg_exo -43.76 -44.86 11.39 Favored 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 123.096 2.531 . . . . 0.0 113.187 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.91 -42.6 98.36 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.738 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.429 HG23 ' O ' ' C' ' 81' ' ' GLY . 86.2 t -60.03 -51.35 73.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.779 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.569 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.53 -32.31 73.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.772 0.32 . . . . 0.0 111.497 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.735 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 7.9 t -69.27 -20.61 63.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.639 0.733 . . . . 0.0 109.209 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.677 HD11 HG21 ' A' ' 12' ' ' VAL . 59.6 tp -75.78 -27.75 58.12 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.218 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.672 ' HE ' HD13 ' B' ' 48' ' ' LEU . 23.4 mmm-85 -63.37 -43.6 97.19 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.735 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.5 -35.59 77.72 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.46 179.067 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' C' ' 87' ' ' SER . 85.4 mt-30 -64.07 -33.41 75.69 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 109.376 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.707 HG21 HD11 ' B' ' 48' ' ' LEU . 54.8 t -72.54 -35.65 51.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.256 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 96.6 mt-10 -65.24 -27.54 68.73 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -68.34 -53.08 26.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.854 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.649 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.4 -34.84 69.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.294 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.635 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.4 tt0 -71.12 -42.81 68.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.169 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.49 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.03 -31.67 77.46 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.86 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.612 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 57.9 mt-30 -75.41 -41.67 55.5 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.558 -0.378 . . . . 0.0 111.132 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -73.96 -27.15 21.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.488 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.49 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 15.6 pt20 -74.12 -41.68 61.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 121.11 -0.236 . . . . 0.0 110.505 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.612 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.6 p-80 -79.29 -19.98 49.13 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.596 -0.842 . . . . 0.0 110.841 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' A' ' 23' ' ' GLN . 1.8 mp -79.37 -34.68 41.77 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.71 ' HG2' HD11 ' B' ' 62' ' ' LEU . 4.3 tm0? -73.81 -31.3 63.17 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 177.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.48 -63.06 1.41 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.678 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -57.82 -43.68 85.92 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.185 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.63 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -53.48 -32.34 49.72 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.384 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 45.9 t -50.91 -33.95 26.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.164 0.507 . . . . 0.0 110.815 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.739 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 33.7 mt-30 -81.99 -46.95 13.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.178 0.514 . . . . 0.0 110.908 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.648 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 26.4 m-85 -70.68 -18.93 62.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.138 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' C' ' 110' ' ' LYS . 14.3 tmtt? -73.38 -24.92 60.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.905 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.739 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -107.21 28.12 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.791 0.805 . . . . 0.0 109.39 176.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.625 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 7.8 t -94.08 -36.9 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.08 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.489 ' HB2' HG21 ' B' ' 72' ' ' VAL . 9.0 tt0 -96.39 102.42 14.21 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.651 1.215 . . . . 0.0 110.808 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.677 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -167.32 -32.83 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.548 -2.115 . . . . 0.0 110.022 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.932 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 43.4 m-85 -71.32 -61.04 2.36 Favored Pre-proline 0 CA--C 1.536 0.411 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 177.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.932 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 41.7 Cg_endo -91.3 -174.01 0.6 Allowed 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.919 2.413 . . . . 0.0 112.57 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -133.16 105.0 6.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.648 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -84.26 141.46 19.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.868 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 103.28 -46.44 1.21 Allowed Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.721 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 27.0 mt . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.068 179.835 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.987 0 N-CA-C 112.039 -0.424 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.503 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 1.1 mm? -57.36 -54.99 49.06 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 117.068 0.434 . . . . 0.0 111.019 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 70.9 Cg_exo -40.92 -46.96 4.95 Favored 'Trans proline' 0 C--N 1.362 1.256 0 C-N-CA 123.615 2.876 . . . . 0.0 113.754 -178.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -63.49 -49.0 75.32 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 58.5 t -61.96 -53.29 49.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.727 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.74 -30.4 71.5 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.622 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 44.4 t -63.96 -30.2 71.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.673 0.749 . . . . 0.0 109.293 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.585 ' O ' HG13 ' A' ' 12' ' ' VAL . 59.2 tp -73.32 -25.73 60.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -69.03 -21.57 64.11 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.493 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.622 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.7 mt-30 -75.62 -40.53 56.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -69.23 -26.24 64.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.283 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 8' ' ' LEU . 15.2 m -78.21 -33.84 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.236 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.507 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 62.7 mm-40 -65.52 -34.4 78.16 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.89 6.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.952 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.598 HD11 HG11 ' B' ' 59' ' ' VAL . 41.8 tp -59.06 -39.34 81.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.742 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.546 ' HA ' HG12 ' A' ' 19' ' ' VAL . 18.0 pt20 -70.08 -23.28 63.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.649 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -68.72 -31.17 72.93 Favored Glycine 0 C--O 1.239 0.428 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.935 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.695 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.1 mm100 -73.27 -49.08 29.62 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.441 0.638 . . . . 0.0 110.629 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.588 HG11 HD11 ' C' ' 95' ' ' LEU . 7.7 p -70.02 -26.34 29.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 C-N-CA 120.226 -0.59 . . . . 0.0 112.027 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -71.66 -42.46 67.49 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.142 -0.349 . . . . 0.0 110.376 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.455 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.0 p-80 -76.2 -18.13 59.21 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.613 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 18.6 mt -74.08 -39.86 63.14 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.696 ' HG2' HD21 ' C' ' 102' ' ' LEU . 16.1 tm0? -69.4 -34.23 74.19 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -54.78 -63.62 1.09 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.289 177.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -59.18 -40.47 85.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.681 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -55.16 -30.82 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.112 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -58.17 -31.52 67.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -88.56 -15.56 34.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.154 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.557 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.0 m-85 -99.96 -15.29 18.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.606 0.717 . . . . 0.0 110.543 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HG2' ' OH ' ' C' ' 109' ' ' TYR . 1.4 tmtp? -64.46 -33.22 75.38 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.793 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -101.38 23.77 10.56 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.253 0.549 . . . . 0.0 110.507 179.398 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.465 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 26.5 t -92.75 -26.27 4.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.545 ' O ' ' HD2' ' A' ' 36' ' ' PRO . 10.3 tm-20 -64.35 -69.61 0.27 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.903 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -43.64 -38.13 2.91 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -177.394 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.642 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 16.4 m-30 -41.32 -72.35 0.12 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.642 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 88.5 Cg_endo -79.37 177.45 8.54 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.192 1.928 . . . . 0.0 112.309 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -110.84 91.94 3.86 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.543 ' HA3' ' CE2' ' C' ' 115' ' ' PHE . . . -71.75 159.74 53.87 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.771 -0.728 . . . . 0.0 113.077 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 131.88 -70.01 0.52 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.942 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.7 mm . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.904 179.517 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.125 0 N-CA-C 112.027 -0.429 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.478 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 1.0 OUTLIER -57.75 -55.06 48.79 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 117.135 0.467 . . . . 0.0 111.132 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 76.6 Cg_exo -40.58 -47.49 4.5 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 123.43 2.753 . . . . 0.0 113.823 -178.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -63.1 -50.05 72.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.79 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 59.8 t -60.88 -52.24 63.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.155 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.45 -30.29 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.036 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.611 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 47.1 t -63.59 -30.55 71.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.638 0.733 . . . . 0.0 109.101 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.567 ' O ' HG13 ' B' ' 52' ' ' VAL . 57.7 tp -73.84 -25.69 60.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.57 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -69.37 -20.29 63.83 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.8 mt-30 -77.03 -40.1 47.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -69.73 -26.61 64.41 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.985 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.567 HG13 ' O ' ' B' ' 48' ' ' LEU . 17.5 m -77.54 -34.32 20.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.302 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.526 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 62.9 mm-40 -65.12 -34.33 78.13 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.75 -59.34 5.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.865 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.559 HD11 HG21 ' C' ' 99' ' ' VAL . 45.4 tp -58.98 -39.11 80.76 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.961 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.554 ' HA ' HG12 ' B' ' 59' ' ' VAL . 17.4 pt20 -70.2 -23.36 62.93 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.623 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -69.36 -29.42 71.81 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.881 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.715 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.1 mm100 -74.35 -48.21 29.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.365 0.603 . . . . 0.0 110.784 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.598 HG11 HD11 ' A' ' 15' ' ' LEU . 6.9 p -70.75 -26.55 28.34 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.713 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.576 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -71.6 -41.99 68.27 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.361 178.409 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.2 p-80 -76.33 -19.57 58.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.595 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 17.8 mt -72.1 -40.8 67.94 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.627 ' HG2' HD21 ' A' ' 22' ' ' LEU . 17.8 tm0? -69.23 -34.07 74.27 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -54.7 -63.14 1.25 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.254 178.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.571 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.64 -39.87 85.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.579 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.534 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.86 -30.04 60.87 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.17 -179.33 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.6 t -59.6 -29.78 68.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.286 0.565 . . . . 0.0 110.79 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -89.07 -15.81 33.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.365 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.571 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 39.2 m-85 -100.66 -15.81 17.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.647 0.737 . . . . 0.0 110.454 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' OH ' ' A' ' 29' ' ' TYR . 1.3 tmtp? -64.5 -32.51 74.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.7 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -101.61 23.8 10.68 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.731 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.475 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 33.4 t -93.07 -26.54 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.511 ' O ' ' HD2' ' B' ' 76' ' ' PRO . 9.2 tm-20 -64.3 -68.43 0.35 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.938 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -44.99 -37.77 4.26 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -177.14 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.63 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 15.3 m-30 -41.16 -72.52 0.11 Allowed Pre-proline 0 N--CA 1.48 1.025 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.63 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 83.5 Cg_endo -79.35 179.12 6.68 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.296 1.997 . . . . 0.0 112.21 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -112.19 91.43 3.65 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' GLY . . . . . 0.521 ' HA3' ' CE2' ' A' ' 35' ' ' PHE . . . -71.36 157.78 53.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.879 -0.676 . . . . 0.0 113.244 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 -68.83 0.54 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.9 mm . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.685 -0.674 . . . . 0.0 109.863 179.334 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.466 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 9.2 mt -62.44 -53.84 54.11 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-O 119.081 -0.485 . . . . 0.0 111.801 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.466 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 77.6 Cg_exo -41.01 -46.53 5.07 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 123.449 2.766 . . . . 0.0 113.085 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -62.71 -51.07 68.62 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.891 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.45 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 62.2 t -60.38 -52.69 58.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.987 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.776 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.65 -28.43 69.61 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 40.9 t -66.38 -29.66 69.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.596 0.712 . . . . 0.0 109.289 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 62.2 tp -73.66 -24.09 59.94 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.909 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.776 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -68.61 -23.32 64.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.711 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.2 mt-30 -75.87 -41.29 52.66 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -69.09 -23.55 64.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.019 178.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.59 -40.81 28.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.277 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.512 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 55.4 mm-40 -64.55 -33.09 75.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.055 0.931 . . . . 0.0 108.56 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.84 6.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.139 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.588 HD11 HG11 ' A' ' 19' ' ' VAL . 42.0 tp -59.52 -40.61 87.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.773 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.618 ' HA ' HG23 ' C' ' 99' ' ' VAL . 17.9 pt20 -68.02 -24.15 65.08 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.575 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -67.39 -30.95 75.81 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.096 -1.05 . . . . 0.0 110.949 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.687 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 9.6 mm100 -72.54 -46.51 54.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.801 0.334 . . . . 0.0 110.269 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.618 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -66.75 -34.69 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.53 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.85 -41.48 87.29 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.675 -177.589 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.475 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 5.4 p-80 -77.64 -19.81 54.86 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.101 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.696 HD21 ' HG2' ' A' ' 23' ' ' GLN . 18.1 mt -73.45 -40.3 64.3 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' B' ' 62' ' ' LEU . 18.2 tm0? -69.82 -34.17 73.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -54.76 -63.18 1.23 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.059 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.569 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.14 -40.15 84.62 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.853 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.63 -31.43 62.3 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.091 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 33.7 t -57.58 -29.21 64.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.158 0.504 . . . . 0.0 110.632 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -90.81 -15.65 29.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.592 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.569 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 41.1 m-85 -100.78 -16.07 17.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.499 0.666 . . . . 0.0 110.642 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.441 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -67.47 -26.73 66.52 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.972 -179.143 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER -104.38 22.43 14.89 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.176 177.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 37.2 t -92.13 -26.3 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.51 ' O ' ' HD2' ' C' ' 116' ' ' PRO . 9.3 tm-20 -64.28 -68.05 0.38 Allowed 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.905 HD13 ' H ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER -44.82 -39.07 4.99 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 -177.331 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.643 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 15.9 m-30 -40.41 -72.13 0.12 Allowed Pre-proline 0 N--CA 1.481 1.079 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.643 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 88.7 Cg_endo -79.11 179.55 6.36 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.201 1.934 . . . . 0.0 112.371 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -113.03 89.79 3.18 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 118' ' ' GLY . . . . . 0.544 ' HA3' ' CE2' ' B' ' 75' ' ' PHE . . . -70.24 157.29 53.52 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.33 -178.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 133.79 -69.57 0.53 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 37.1 mm . . . . . 0 C--O 1.245 0.868 0 CA-C-O 118.582 -0.723 . . . . 0.0 109.89 179.386 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.781 ' HA2' HD22 ' B' ' 42' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.808 HD22 ' HA2' ' C' ' 81' ' ' GLY . 32.6 mt -57.45 -55.38 45.11 Favored Pre-proline 0 N--CA 1.467 0.422 0 CA-C-O 119.254 -0.403 . . . . 0.0 111.566 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.572 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 32.4 Cg_exo -45.58 -46.91 14.13 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.905 2.403 . . . . 0.0 112.323 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.839 ' HB3' HH22 ' B' ' 49' ' ' ARG . 3.1 m-20 -58.37 -34.63 70.89 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.425 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.576 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 91.1 t -61.14 -47.93 91.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.217 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.09 -32.43 73.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.841 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.702 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 34.5 m -71.4 -23.11 61.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.857 0.837 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.406 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 62.0 tp -77.89 -22.53 49.62 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.792 HH22 ' HB3' ' C' ' 84' ' ' ASP . 0.0 OUTLIER -64.14 -44.13 93.13 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.056 178.227 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.702 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -70.39 -47.22 61.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.269 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -61.64 -39.12 90.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.241 0.543 . . . . 0.0 110.838 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 2.6 t -73.2 -27.38 24.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.958 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 19.1 tt0 -67.31 -33.64 75.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.66 -60.83 2.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.632 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.429 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.4 mm? -57.32 -37.21 72.13 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.371 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 11.4 pt20 -72.16 -30.41 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.43 -30.32 77.31 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.756 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 35.8 mt-30 -70.56 -48.36 55.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.896 -0.652 . . . . 0.0 110.669 178.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.93 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 10.5 pt20 -59.79 -43.35 94.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.316 -178.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 5.1 p-80 -79.11 -14.55 59.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.544 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -75.66 -42.43 51.33 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.73 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.1 tm0? -68.77 -38.97 80.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.05 72.32 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.484 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.59 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.31 -47.15 85.53 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.118 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.44 ' CD2' HD22 ' C' ' 102' ' ' LEU . 5.5 m-85 -50.3 -25.77 4.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 47.7 t -49.64 -30.0 8.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.634 ' HG3' ' OE1' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -107.84 -11.62 15.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' B' ' 70' ' ' LYS . 55.0 m-85 -94.94 -21.87 18.35 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.771 -0.581 . . . . 0.0 109.696 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HA ' ' CE2' ' C' ' 109' ' ' TYR . 22.7 pttp -59.64 -21.15 60.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.746 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -103.97 33.55 3.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.444 178.316 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.691 HG12 HG11 ' C' ' 112' ' ' VAL . 71.1 t -124.91 -24.87 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.963 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.78 ' HG3' HD13 ' A' ' 34' ' ' LEU . 16.9 pt-20 -61.76 -40.77 96.29 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.78 HD13 ' HG3' ' A' ' 33' ' ' GLU . 0.5 OUTLIER -54.82 -74.45 0.04 OUTLIER 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -176.351 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -104.31 53.03 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -174.142 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.455 ' HD2' ' O ' ' A' ' 34' ' ' LEU . 48.0 Cg_endo -64.41 175.28 3.51 Favored 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 121.914 1.743 . . . . 0.0 110.623 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -111.51 80.28 1.3 Allowed 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.911 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -100.66 46.67 1.31 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.442 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -103.6 -88.17 2.04 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.742 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 42.1 mm . . . . . 0 C--O 1.244 0.77 0 CA-C-O 118.565 -0.731 . . . . 0.0 110.552 -179.681 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.403 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.872 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.781 HD22 ' HA2' ' A' ' 1' ' ' GLY . 32.6 mt -58.67 -55.93 40.97 Favored Pre-proline 0 N--CA 1.469 0.49 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.543 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 31.7 Cg_exo -45.23 -45.83 14.48 Favored 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.996 2.464 . . . . 0.0 112.597 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.821 ' HB3' HH22 ' C' ' 89' ' ' ARG . 2.3 m-20 -59.51 -32.87 70.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.517 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.59 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 99.1 t -63.04 -47.44 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.95 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.7 -31.84 72.08 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.819 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 40.5 m -71.47 -23.78 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.678 0.751 . . . . 0.0 109.297 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.401 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 64.4 tp -77.57 -22.29 51.19 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.839 HH22 ' HB3' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -63.94 -44.66 92.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.071 178.045 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.0 OUTLIER -69.93 -47.69 61.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -61.3 -38.55 87.2 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.455 0.645 . . . . 0.0 110.912 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.401 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 2.6 t -74.03 -27.28 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.105 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.471 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 22.0 tt0 -67.3 -33.01 74.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.16 -59.83 3.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.835 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' B' ' 55' ' ' LEU . 3.4 mm? -58.55 -37.25 75.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.706 -1.134 . . . . 0.0 112.105 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.471 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 10.8 pt20 -71.83 -30.09 65.11 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.632 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.401 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -65.44 -31.82 81.51 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.79 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 35.6 mt-30 -69.85 -47.23 63.49 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.928 -0.636 . . . . 0.0 110.727 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.451 HG23 ' HA ' ' B' ' 56' ' ' GLN . 0.9 OUTLIER -63.12 -44.62 99.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.693 -179.319 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 11.0 pt20 -59.26 -42.44 91.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.6 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.443 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -80.31 -15.07 57.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.288 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.3 mt -74.82 -42.16 58.57 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 1.9 tm0? -69.12 -38.82 79.1 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.136 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.71 -48.94 71.85 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.202 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -60.95 -47.49 86.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.099 178.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.425 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.3 m-85 -50.38 -26.15 4.65 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 67' ' ' SER . . . . . 0.453 ' O ' ' HE3' ' B' ' 70' ' ' LYS . 46.7 t -49.55 -30.11 8.0 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.633 ' HG3' ' OE1' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -108.25 -9.34 15.53 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.557 ' HE1' ' HB1' ' B' ' 65' ' ' ALA . 60.6 m-85 -97.27 -21.41 17.27 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.532 ' HA ' ' CE2' ' A' ' 29' ' ' TYR . 22.6 pttp -59.16 -22.05 60.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.668 -178.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -103.5 33.77 3.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.537 0.684 . . . . 0.0 110.584 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.721 HG11 HG12 ' C' ' 112' ' ' VAL . 72.1 t -125.29 -24.27 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.835 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.806 ' HG3' HD13 ' B' ' 74' ' ' LEU . 17.1 pt-20 -61.8 -40.39 95.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.806 HD13 ' HG3' ' B' ' 73' ' ' GLU . 0.5 OUTLIER -55.71 -74.22 0.05 OUTLIER 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.089 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.432 ' CD1' ' N ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -104.28 52.21 0.09 OUTLIER Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 117.478 2.399 . . . . 0.0 117.478 -174.134 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.462 ' HD2' ' O ' ' B' ' 74' ' ' LEU . 44.5 Cg_endo -63.9 176.01 2.69 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.901 1.734 . . . . 0.0 110.527 176.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -112.12 80.36 1.32 Allowed 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.789 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.32 47.38 1.27 Allowed Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.493 -0.861 . . . . 0.0 112.26 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -105.19 -88.02 2.03 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.314 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.4 mm . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.325 179.73 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.808 ' HA2' HD22 ' A' ' 2' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.13 -56.02 38.02 Favored Pre-proline 0 N--CA 1.469 0.505 0 CA-C-O 119.357 -0.354 . . . . 0.0 111.671 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 83' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -45.75 -46.6 15.01 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.742 2.295 . . . . 0.0 112.626 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 84' ' ' ASP . . . . . 0.792 ' HB3' HH22 ' A' ' 9' ' ' ARG . 2.6 m-20 -59.28 -31.87 69.51 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.674 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.605 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 93.2 t -63.86 -47.48 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.041 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.14 -31.93 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.734 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.704 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 22.5 m -71.75 -23.87 61.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.811 0.815 . . . . 0.0 109.545 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.41 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 62.9 tp -77.42 -22.32 51.72 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.821 HH22 ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -64.39 -43.24 95.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.252 178.087 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.1 pt20 -71.46 -47.35 56.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.196 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -61.31 -39.07 89.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.217 0.532 . . . . 0.0 111.005 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 2.6 t -73.31 -27.81 24.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.068 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.462 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 22.9 tt0 -66.86 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.37 -59.98 3.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.902 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.6 mm? -58.48 -35.86 72.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.275 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.486 ' O ' ' HG2' ' C' ' 100' ' ' GLN . 11.1 pt20 -73.58 -30.26 62.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.409 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.45 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.23 -29.52 75.07 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 177.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.772 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 35.8 mt-30 -72.27 -49.55 33.96 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.015 -0.593 . . . . 0.0 111.019 178.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.424 HG21 HG22 ' B' ' 59' ' ' VAL . 1.6 p -66.5 -34.61 71.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 10.4 pt20 -64.89 -43.97 91.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.554 -0.459 . . . . 0.0 111.104 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.427 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.8 p-80 -77.94 -15.13 59.24 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.83 -0.748 . . . . 0.0 111.037 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.772 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.1 mt -73.9 -41.62 61.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.2 tm0? -69.95 -37.97 76.0 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.14 74.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.379 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.598 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -61.25 -47.89 83.96 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.799 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.449 ' CD2' HD22 ' B' ' 62' ' ' LEU . 3.0 m-85 -49.6 -26.18 3.39 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 107' ' ' SER . . . . . 0.467 ' O ' ' HE3' ' C' ' 110' ' ' LYS . 36.9 t -49.79 -30.52 9.79 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.629 ' HG3' ' OE1' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -106.87 -11.41 15.74 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.557 ' CE2' ' HA ' ' A' ' 30' ' ' LYS . 53.1 m-85 -94.94 -21.93 18.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.645 178.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.554 ' HA ' ' CE2' ' B' ' 69' ' ' TYR . 22.8 pttp -59.28 -21.19 59.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.003 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.09 33.52 3.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 110.325 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.721 HG12 HG11 ' B' ' 72' ' ' VAL . 70.3 t -125.29 -25.92 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.59 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.633 ' OE1' ' HG3' ' B' ' 68' ' ' GLN . 16.6 pt-20 -59.7 -42.72 93.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.4 OUTLIER -55.81 -69.96 0.13 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -176.028 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.09 52.09 0.21 Allowed Pre-proline 0 C--N 1.313 -1.01 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.415 ' HD2' ' O ' ' C' ' 114' ' ' LEU . 56.1 Cg_endo -64.01 174.94 3.47 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 122.193 1.928 . . . . 0.0 110.646 176.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -112.15 81.68 1.51 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.738 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -101.3 46.66 1.27 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.339 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.19 -88.86 2.08 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.479 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 40.5 mm . . . . . 0 C--O 1.244 0.78 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.05 179.685 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.871 0 N-CA-C 112.126 -0.389 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.501 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 6.6 mp -57.9 -57.42 25.83 Favored Pre-proline 0 N--CA 1.467 0.4 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 1.1 Cg_endo -51.07 -36.21 53.86 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.993 2.462 . . . . 0.0 112.602 -178.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.98 -34.13 72.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.864 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.5 t -76.55 -47.29 29.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.328 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.825 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -70.74 -20.79 62.6 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.74 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.653 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 32.1 t -67.88 -27.63 66.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.54 HD11 HG11 ' B' ' 52' ' ' VAL . 65.2 tp -74.34 -22.85 59.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.626 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.825 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 mmt85 -69.5 -22.1 63.63 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.653 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.5 mt-30 -73.75 -39.31 64.32 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 9.8 mm100 -69.52 -33.17 72.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.577 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.723 HG22 ' HA ' ' A' ' 9' ' ' ARG . 29.0 m -74.53 -31.61 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.697 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.579 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.2 mt-10 -70.43 -29.73 66.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.48 -53.03 48.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.611 177.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.523 HD11 ' HA ' ' B' ' 56' ' ' GLN . 3.9 mm? -57.71 -37.4 73.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.233 -1.349 . . . . 0.0 111.632 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.647 ' HA ' HG12 ' A' ' 19' ' ' VAL . 19.6 pt20 -76.48 -25.03 53.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.215 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.522 ' HA2' ' OE1' ' A' ' 20' ' ' GLN . . . -69.7 -37.52 76.63 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.801 -1.19 . . . . 0.0 110.701 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.703 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 65.4 mt-30 -72.88 -46.63 51.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.026 -0.587 . . . . 0.0 111.321 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.647 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.8 p -69.23 -32.83 55.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.693 -179.028 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.522 ' OE1' ' HA2' ' A' ' 17' ' ' GLY . 18.2 pt20 -67.55 -41.74 83.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.842 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.3 p-80 -78.61 -19.44 52.68 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.271 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.733 HD21 ' HG2' ' B' ' 63' ' ' GLN . 14.2 mt -71.95 -43.73 64.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' C' ' 102' ' ' LEU . 3.6 tm0? -70.38 -33.34 71.29 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.35 -56.05 26.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.866 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.38 -41.38 98.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.132 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.67 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.96 -26.06 59.02 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.519 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -53.43 -26.64 20.78 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.27 0.557 . . . . 0.0 110.34 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -93.02 -53.66 4.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.589 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 21.7 m-85 -63.13 -20.15 65.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -67.09 -24.27 65.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.781 0.324 . . . . 0.0 110.756 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.84 34.21 3.97 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.748 0.785 . . . . 0.0 109.708 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.605 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 10.8 t -98.78 -33.6 4.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.942 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.66 88.57 7.16 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 122.707 1.241 . . . . 0.0 111.665 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.645 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -166.44 -32.13 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 112.438 -2.165 . . . . 0.0 110.296 178.719 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.645 ' H ' HD23 ' A' ' 34' ' ' LEU . 42.2 m-85 -71.16 -59.7 3.21 Favored Pre-proline 0 CA--C 1.531 0.241 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.598 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 73.8 Cg_endo -78.99 178.74 7.19 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.955 1.77 . . . . 0.0 111.583 179.046 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.524 ' HB2' ' CZ ' ' C' ' 115' ' ' PHE . 6.5 m120 -70.3 -52.07 25.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.765 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.36 -100.18 2.33 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -89.74 82.18 1.42 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.28 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.0 tp . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.424 -179.164 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.417 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 112.273 -0.331 . . . . 0.0 112.273 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 6.8 mp -59.08 -57.04 30.04 Favored Pre-proline 0 N--CA 1.465 0.294 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 1.2 Cg_endo -50.94 -34.49 46.16 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.987 2.458 . . . . 0.0 112.536 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.97 -36.22 72.44 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.697 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.417 HG23 ' O ' ' B' ' 41' ' ' GLY . 79.1 t -75.03 -47.68 35.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.412 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.798 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -70.59 -20.62 62.75 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.641 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 19.3 t -68.42 -26.8 65.72 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.551 HD11 HG11 ' C' ' 92' ' ' VAL . 63.6 tp -74.32 -23.26 59.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.522 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.798 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 9.1 mmt85 -69.26 -22.08 63.86 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.3 mt-30 -74.4 -38.16 63.19 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.475 ' O ' HD23 ' B' ' 55' ' ' LEU . 10.1 mm100 -70.57 -32.94 70.54 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.391 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' B' ' 49' ' ' ARG . 28.0 m -74.73 -31.55 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.662 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.588 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 50.7 mt-10 -70.52 -30.03 66.69 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.25 -53.09 49.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.615 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.46 -37.66 73.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.632 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.643 ' HA ' HG12 ' B' ' 59' ' ' VAL . 19.5 pt20 -76.4 -25.34 54.43 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.368 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.506 ' HA2' ' OE1' ' B' ' 60' ' ' GLN . . . -69.61 -37.43 77.46 Favored Glycine 0 C--O 1.242 0.6 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.663 178.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 69.3 mt-30 -72.53 -47.18 50.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.251 -0.475 . . . . 0.0 111.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' B' ' 56' ' ' GLN . 15.0 p -68.74 -32.57 55.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 C-N-CA 120.305 -0.558 . . . . 0.0 112.012 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.506 ' OE1' ' HA2' ' B' ' 57' ' ' GLY . 18.2 pt20 -68.23 -40.91 81.9 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.965 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.2 p-80 -79.18 -19.14 51.63 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.728 HD21 ' HG2' ' C' ' 103' ' ' GLN . 14.6 mt -72.33 -43.19 64.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.733 ' HG2' HD21 ' A' ' 22' ' ' LEU . 3.4 tm0? -70.85 -33.75 70.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.92 -56.39 22.32 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.913 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.756 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.45 -40.77 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.092 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.689 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -57.46 -26.05 60.63 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.485 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t -53.67 -26.64 23.44 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.166 0.508 . . . . 0.0 110.459 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 58.9 mm-40 -92.29 -54.84 3.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.459 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.756 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -62.03 -20.12 63.61 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -67.03 -23.46 65.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.849 -179.288 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 33.14 4.74 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.621 0.724 . . . . 0.0 109.678 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.632 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 16.2 t -97.1 -34.45 4.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.206 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -89.97 89.57 7.78 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 122.549 1.166 . . . . 0.0 111.414 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.627 HD23 ' N ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -167.9 -30.93 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 112.486 -2.143 . . . . 0.0 110.393 178.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.627 ' N ' HD23 ' B' ' 74' ' ' LEU . 42.0 m-85 -72.82 -58.78 2.55 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 75.7 Cg_endo -79.47 178.45 7.37 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.05 1.833 . . . . 0.0 111.814 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' ASN . . . . . 0.488 ' HB2' ' CZ ' ' A' ' 35' ' ' PHE . 7.0 m120 -70.59 -47.55 59.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.271 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.23 -102.26 2.04 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -178.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -89.39 85.03 1.41 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.25 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.415 ' HB ' ' HB3' ' B' ' 77' ' ' ASN . 8.7 tp . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.731 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.408 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.735 0 N-CA-C 112.166 -0.374 . . . . 0.0 112.166 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.509 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 9.5 mt -59.99 -55.6 43.95 Favored Pre-proline 0 N--CA 1.468 0.436 0 CA-C-N 116.708 0.254 . . . . 0.0 111.67 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 1.3 Cg_endo -51.64 -33.91 50.93 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 123.055 2.503 . . . . 0.0 112.757 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -72.14 -34.61 68.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.519 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.408 HG23 ' O ' ' C' ' 81' ' ' GLY . 69.1 t -76.55 -47.46 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 178.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.828 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -70.5 -20.82 62.81 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 25.0 t -67.94 -27.35 66.54 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 12' ' ' VAL . 65.8 tp -74.26 -22.8 59.16 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.761 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.828 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 9.0 mmt85 -69.59 -22.48 63.51 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.6 mt-30 -74.26 -37.21 63.82 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.469 ' O ' HD23 ' C' ' 95' ' ' LEU . 10.2 mm100 -71.63 -32.75 68.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.29 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.746 HG22 ' HA ' ' C' ' 89' ' ' ARG . 27.5 m -74.63 -31.83 27.97 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.609 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.552 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 49.5 mt-10 -69.72 -30.72 68.41 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.03 -52.98 52.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.777 -1.102 . . . . 0.0 109.706 177.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.517 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.6 -37.69 73.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.696 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.664 ' HA ' HG12 ' C' ' 99' ' ' VAL . 19.5 pt20 -76.23 -25.15 54.76 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.318 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.513 ' HA2' ' OE1' ' C' ' 100' ' ' GLN . . . -69.69 -37.2 76.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 119.9 -1.143 . . . . 0.0 110.729 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.709 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 68.1 mt-30 -73.34 -46.26 50.28 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.419 . . . . 0.0 111.22 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.664 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.7 p -69.45 -32.47 53.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.667 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.513 ' OE1' ' HA2' ' C' ' 97' ' ' GLY . 17.6 pt20 -67.84 -42.17 81.83 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.866 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.1 p-80 -78.43 -18.88 54.31 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.454 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.729 HD21 ' HG2' ' A' ' 23' ' ' GLN . 14.3 mt -72.4 -43.59 63.69 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 177.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.728 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.0 tm0? -70.12 -34.19 72.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 178.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.63 -55.86 28.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.24 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.742 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.45 -40.8 98.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.829 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.695 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -57.57 -24.43 56.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.728 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 31.5 t -55.46 -26.46 42.4 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 110.391 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -92.78 -52.94 4.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.272 178.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.742 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 22.0 m-85 -63.18 -20.51 65.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 0.1 OUTLIER -66.49 -25.91 66.93 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.837 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.531 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -107.66 35.08 3.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.832 0.825 . . . . 0.0 109.949 178.783 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.566 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 12.6 t -99.42 -35.83 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.166 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.563 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 27.1 tt0 -88.92 90.46 8.42 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 122.681 1.229 . . . . 0.0 111.141 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.683 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -167.46 -37.41 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 112.581 -2.1 . . . . 0.0 109.421 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.683 ' H ' HD12 ' C' ' 114' ' ' LEU . 42.2 m-85 -67.71 -59.58 6.59 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.789 177.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.583 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 73.7 Cg_endo -79.33 -179.69 5.63 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.986 1.791 . . . . 0.0 111.565 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 117' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' B' ' 75' ' ' PHE . 6.0 m120 -72.45 -48.6 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 111.134 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.11 -100.46 2.0 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -89.1 82.7 1.46 Allowed Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 111.303 -0.719 . . . . 0.0 111.303 178.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 120' ' ' ILE . . . . . 0.417 ' HB ' ' HB3' ' C' ' 117' ' ' ASN . 8.8 tp . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.342 -0.837 . . . . 0.0 110.454 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.459 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.794 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.531 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 60.5 mt -55.7 -53.2 65.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.947 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.531 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 77.0 Cg_exo -46.34 -46.14 17.48 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 122.803 2.335 . . . . 0.0 112.918 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.15 -33.43 73.41 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.221 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 1' ' ' GLY . 60.1 t -63.27 -55.72 21.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.82 95.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.89 0.376 . . . . 0.0 111.416 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 23.4 m -63.7 -31.03 72.07 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 122.095 0.95 . . . . 0.0 110.353 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HG21 ' B' ' 52' ' ' VAL . 37.0 tp -75.18 -54.54 6.95 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.81 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.878 ' HB3' HD22 ' C' ' 88' ' ' LEU . 0.0 OUTLIER -58.26 -28.58 65.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 123.44 0.463 . . . . 0.0 112.067 -179.024 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.7 pt20 -70.63 -42.4 70.94 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -65.63 -10.3 34.64 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.948 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.92 HG21 HD11 ' C' ' 88' ' ' LEU . 15.7 t -78.57 -38.57 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-O 120.458 0.17 . . . . 0.0 110.769 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 21.9 pt-20 -73.26 -19.17 61.12 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.9 -49.63 23.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.513 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' B' ' 55' ' ' LEU . 10.4 tp -61.71 -33.58 74.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.351 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.593 ' HA ' HD21 ' C' ' 95' ' ' LEU . 1.9 tp-100 -68.53 -42.32 78.65 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.581 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.65 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.77 -30.04 71.71 Favored Glycine 0 C--O 1.236 0.235 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.513 ' HA ' ' ND1' ' A' ' 21' ' ' HIS . 73.5 mt-30 -73.31 -47.4 42.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.263 0.554 . . . . 0.0 110.834 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.1 p -69.64 -26.41 30.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.337 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 15.4 pt20 -73.6 -39.58 64.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.513 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 9.7 p-80 -80.44 -12.29 59.58 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.02 -0.672 . . . . 0.0 109.783 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.683 HD21 ' HG2' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -76.01 -39.21 56.24 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 176.122 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.929 ' HG2' HD11 ' C' ' 102' ' ' LEU . 69.8 mt-30 -70.74 -31.13 67.85 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.24 -44.17 97.17 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.642 177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.624 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.18 -49.67 76.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.732 178.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.494 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 6.5 m-85 -54.96 -25.71 31.54 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.984 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -51.63 -31.8 26.66 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 110.748 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.422 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 76.0 mt-30 -88.55 -54.58 4.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.371 0.605 . . . . 0.0 110.502 178.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.679 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.4 m-85 -63.74 -19.46 64.97 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 21.0 ptmt -68.91 -30.29 68.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.611 0.243 . . . . 0.0 110.883 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -102.15 28.16 6.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.899 0.857 . . . . 0.0 109.813 178.394 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.679 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 24.4 t -94.03 -44.34 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.577 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 5.6 tt0 -111.6 109.76 19.82 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 122.276 1.036 . . . . 0.0 110.065 177.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.856 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -172.29 -33.86 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 113.013 -1.903 . . . . 0.0 109.434 -179.049 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.856 ' H ' HD23 ' A' ' 34' ' ' LEU . 18.1 m-85 -70.5 -53.82 9.41 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.032 177.528 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.719 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 84.1 Cg_endo -82.51 -177.06 3.23 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.391 2.061 . . . . 0.0 112.159 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.8 p30 -135.07 13.53 3.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.682 0.277 . . . . 0.0 111.393 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.47 -99.94 1.91 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.526 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 8.49 6.44 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.159 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 mm . . . . . 0 C--O 1.243 0.722 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.29 179.456 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.466 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.95 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.524 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 62.6 mt -56.64 -52.16 75.7 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 71.9 Cg_exo -47.32 -46.23 20.36 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 122.782 2.322 . . . . 0.0 112.679 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.25 -35.13 74.79 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.466 HG23 ' O ' ' B' ' 41' ' ' GLY . 58.2 t -61.88 -55.09 26.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.194 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -41.04 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 0.0 111.244 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' B' ' 50' ' ' GLN . 35.2 m -63.72 -31.38 72.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.259 1.028 . . . . 0.0 110.241 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.969 HD11 HG21 ' C' ' 92' ' ' VAL . 34.5 tp -75.07 -54.91 6.34 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.827 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.916 ' HB3' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -57.61 -28.96 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.465 0.478 . . . . 0.0 111.969 -178.818 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' B' ' 53' ' ' GLU . 2.6 pt20 -70.43 -42.87 71.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.59 -10.58 36.73 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.629 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.958 HG21 HD11 ' A' ' 8' ' ' LEU . 16.2 t -78.18 -37.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.961 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' B' ' 50' ' ' GLN . 22.9 pt-20 -74.08 -18.69 60.78 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -48.52 27.46 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.184 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.832 HD21 ' HB3' ' C' ' 95' ' ' LEU . 10.8 tp -62.66 -32.86 73.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -69.42 -42.65 74.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.577 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.632 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.99 -30.26 69.66 Favored Glycine 0 CA--C 1.52 0.375 0 N-CA-C 111.124 -0.791 . . . . 0.0 111.124 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.511 ' HA ' ' ND1' ' B' ' 61' ' ' HIS . 73.3 mt-30 -72.62 -48.86 36.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.341 0.591 . . . . 0.0 111.046 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 2.4 p -69.14 -26.2 31.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.254 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 15.1 pt20 -73.59 -39.48 64.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.511 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 9.5 p-80 -80.63 -11.4 59.65 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.813 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.594 HD21 ' HG2' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -76.46 -38.83 54.79 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 176.132 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.683 ' HG2' HD21 ' A' ' 22' ' ' LEU . 70.8 mt-30 -70.76 -31.27 68.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 177.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.56 96.35 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.542 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.82 -49.65 76.63 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.879 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.617 ' HE2' HD13 ' A' ' 22' ' ' LEU . 6.7 m-85 -55.56 -25.37 37.54 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.898 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.2 t -52.3 -31.13 31.52 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 118.045 0.384 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.434 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 76.8 mt-30 -88.56 -54.48 4.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.33 0.585 . . . . 0.0 110.621 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.685 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.9 m-85 -63.66 -20.05 65.39 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.563 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 21.1 ptmt -68.55 -30.5 69.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.645 0.26 . . . . 0.0 110.89 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.642 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.38 26.48 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.644 0.735 . . . . 0.0 110.068 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.685 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 25.0 t -92.47 -44.14 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.953 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 10.0 tt0 -112.28 109.93 19.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.32 1.057 . . . . 0.0 109.787 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.853 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -172.31 -33.8 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.161 -178.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.853 ' H ' HD23 ' B' ' 74' ' ' LEU . 18.4 m-85 -70.87 -53.85 8.4 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.244 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 71.9 Cg_endo -82.03 -176.14 2.86 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.3 2.0 . . . . 0.0 112.143 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 18.3 p30 -135.46 12.22 3.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.176 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.54 -99.43 1.84 Allowed Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.31 6.35 6.87 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.199 -1.0 . . . . 0.0 113.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm . . . . . 0 C--O 1.243 0.729 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.13 179.712 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.444 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.898 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.516 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 67.8 mt -57.07 -53.92 60.06 Favored Pre-proline 0 N--CA 1.465 0.296 0 CA-C-O 119.174 -0.441 . . . . 0.0 111.733 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.516 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 71.0 Cg_exo -45.48 -45.42 15.81 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.617 2.212 . . . . 0.0 112.674 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -33.19 73.54 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.299 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.444 HG23 ' O ' ' C' ' 81' ' ' GLY . 66.4 t -63.54 -56.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.426 0.453 . . . . 0.0 110.863 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.511 ' O ' ' HG2' ' C' ' 90' ' ' GLN . . . -63.85 -43.31 96.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 110.97 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 40.6 m -62.47 -30.58 71.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.937 0.875 . . . . 0.0 110.649 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.92 HD11 HG21 ' A' ' 12' ' ' VAL . 32.8 tp -76.85 -53.53 7.78 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.778 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.886 ' HB3' HD22 ' B' ' 48' ' ' LEU . 0.0 OUTLIER -57.83 -29.52 65.01 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.528 0.518 . . . . 0.0 111.708 -179.033 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' C' ' 93' ' ' GLU . 2.9 pt20 -69.72 -43.28 72.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 176.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 71.9 mt-30 -64.42 -11.82 37.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.915 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.969 HG21 HD11 ' B' ' 48' ' ' LEU . 17.2 t -77.36 -38.85 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 O-C-N 122.346 -0.221 . . . . 0.0 111.141 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' C' ' 90' ' ' GLN . 21.8 pt-20 -73.51 -17.21 61.24 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -74.86 -49.38 20.7 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.35 177.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.832 ' HB3' HD21 ' B' ' 55' ' ' LEU . 3.3 mt -59.76 -37.1 78.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.617 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -66.07 -40.81 91.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.622 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.618 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -61.38 -30.28 73.81 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.524 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 73.4 mt-30 -73.59 -47.86 37.14 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.751 -0.264 . . . . 0.0 110.578 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.491 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -65.9 -32.31 57.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.389 179.334 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 13.7 pt20 -68.36 -39.73 81.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -178.332 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.524 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 13.0 p-80 -81.43 -10.54 59.49 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.795 178.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.929 HD11 ' HG2' ' A' ' 23' ' ' GLN . 0.8 OUTLIER -81.4 -33.5 32.19 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.245 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.594 ' HG2' HD21 ' B' ' 62' ' ' LEU . 71.5 mt-30 -74.45 -29.52 61.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 175.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -62.99 -44.91 94.72 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.478 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.92 -49.99 75.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.688 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.539 ' CE2' HD13 ' B' ' 62' ' ' LEU . 6.5 m-85 -55.04 -25.73 32.56 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.092 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.6 t -51.69 -30.47 22.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.105 0.411 . . . . 0.0 110.594 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.439 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 77.0 mt-30 -89.66 -54.6 3.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.556 0.693 . . . . 0.0 110.678 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.677 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -63.46 -20.2 65.38 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.985 -1.007 . . . . 0.0 113.56 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.569 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 21.3 ptmt -68.37 -30.03 68.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 111.154 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.99 27.04 6.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.693 0.759 . . . . 0.0 109.924 178.533 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.677 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 24.9 t -92.94 -44.22 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.903 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.642 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 6.2 tt0 -112.31 109.54 19.24 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.164 0.983 . . . . 0.0 109.838 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.874 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -171.87 -34.61 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 113.033 -1.894 . . . . 0.0 108.977 -178.66 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.874 ' H ' HD23 ' C' ' 114' ' ' LEU . 17.0 m-85 -70.39 -54.17 9.27 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.27 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.69 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 81.6 Cg_endo -82.33 -178.93 4.3 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.223 1.949 . . . . 0.0 112.147 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -132.13 11.93 4.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.149 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 102.87 -100.62 1.98 Allowed Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 126.44 6.16 5.78 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.135 -1.031 . . . . 0.0 112.957 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 40.1 mm . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.4 179.829 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.927 0 N-CA-C 112.078 -0.409 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.535 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 3.4 mm? -61.46 -54.6 50.94 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.061 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 74.9 Cg_exo -44.35 -42.82 13.71 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.965 2.443 . . . . 0.0 113.125 -178.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -63.12 -34.3 77.31 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.133 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -59.52 -54.75 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.437 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.78 -37.38 86.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.894 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.748 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -65.96 -22.9 66.5 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.585 0.707 . . . . 0.0 109.899 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.751 ' O ' HG23 ' A' ' 12' ' ' VAL . 52.7 tp -75.91 -30.57 58.8 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.231 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.542 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mmm-85 -62.88 -39.62 95.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.748 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.48 -37.21 79.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.59 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 7' ' ' SER . 82.7 mt-30 -64.24 -30.0 71.07 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.213 0.53 . . . . 0.0 109.868 178.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 8' ' ' LEU . 83.4 t -72.68 -40.27 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.457 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 13.8 tp10 -63.25 -33.99 76.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 122.159 0.981 . . . . 0.0 108.779 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.01 -61.29 2.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.087 -1.415 . . . . 0.0 111.268 178.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.516 HD21 HG11 ' B' ' 59' ' ' VAL . 2.6 tm? -59.51 -38.87 82.08 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.416 -1.266 . . . . 0.0 111.662 -178.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 11.6 pt20 -70.77 -23.32 62.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.436 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.651 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.36 -27.55 73.54 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.035 -1.078 . . . . 0.0 110.44 177.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 80.1 mm-40 -75.04 -48.12 25.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.086 0.47 . . . . 0.0 110.71 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' GLN . 2.4 p -67.97 -33.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.817 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.651 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 4.4 pt20 -66.32 -43.92 84.85 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.877 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.502 ' N ' ' HG3' ' A' ' 20' ' ' GLN . 7.8 p-80 -76.34 -16.08 59.83 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.747 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.9 mt -73.3 -36.93 66.36 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.535 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.8 tm0? -70.99 -33.98 70.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.41 -51.91 67.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.704 177.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.711 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.58 -38.6 90.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.507 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.429 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -55.7 -30.03 60.41 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.369 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 t -49.22 -27.3 3.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.993 0.425 . . . . 0.0 111.13 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -96.04 -45.61 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 22.4 m-85 -68.42 -21.51 64.66 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 45.9 mtpt -71.21 -28.68 64.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.721 0.295 . . . . 0.0 111.159 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.447 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -100.17 30.31 3.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.665 0.745 . . . . 0.0 109.677 178.592 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.565 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 13.0 t -95.66 -42.56 12.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.952 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.54 ' HB2' HG22 ' C' ' 112' ' ' VAL . 18.9 tt0 -103.44 101.87 11.77 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.086 0.946 . . . . 0.0 111.034 178.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.805 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -175.7 -33.41 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 112.905 -1.952 . . . . 0.0 110.291 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.805 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -117.22 -9.91 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.204 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 178.783 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.505 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 66.8 Cg_endo -84.86 167.51 11.18 Favored 'Trans proline' 0 C--N 1.366 1.478 0 CA-C-N 122.305 1.859 . . . . 0.0 113.382 -178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -132.84 175.13 9.61 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.162 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -89.71 125.36 7.81 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.107 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -96.19 17.69 58.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.279 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.8 mt . . . . . 0 C--O 1.243 0.758 0 CA-C-O 118.607 -0.711 . . . . 0.0 109.967 179.729 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.524 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 3.4 mm? -61.22 -54.3 54.72 Favored Pre-proline 0 N--CA 1.469 0.506 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.226 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.9 Cg_exo -44.34 -42.27 13.63 Favored 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 123.044 2.496 . . . . 0.0 113.079 -178.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -63.66 -34.82 78.69 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.308 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 87.1 t -58.83 -55.04 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.475 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.535 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -65.72 -37.55 86.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.195 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.734 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 51.1 m -66.25 -22.29 66.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.641 0.734 . . . . 0.0 109.76 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.738 ' O ' HG23 ' B' ' 52' ' ' VAL . 50.6 tp -75.93 -31.12 58.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.321 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.536 ' HE ' HD13 ' A' ' 8' ' ' LEU . 16.7 mmm-85 -62.75 -39.74 95.08 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.734 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -68.0 -37.72 81.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.717 178.657 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' B' ' 47' ' ' SER . 82.3 mt-30 -63.99 -30.21 71.3 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.459 0.647 . . . . 0.0 109.889 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 48' ' ' LEU . 77.6 t -71.72 -41.48 70.71 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.046 179.211 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 15.1 tp10 -62.04 -33.57 74.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.218 1.009 . . . . 0.0 108.93 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.71 -60.67 2.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.465 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.406 HD21 HG21 ' C' ' 99' ' ' VAL . 2.6 tm? -59.99 -38.87 83.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.568 -1.197 . . . . 0.0 111.571 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' B' ' 59' ' ' VAL . 12.2 pt20 -70.27 -24.41 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.384 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.64 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -66.99 -26.7 73.27 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 119.924 -1.131 . . . . 0.0 110.441 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 80.9 mm-40 -75.86 -48.6 20.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.317 0.58 . . . . 0.0 110.72 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' B' ' 56' ' ' GLN . 2.4 p -67.93 -31.69 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.687 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.64 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 3.1 pt20 -67.74 -43.67 79.38 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.785 178.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.526 ' N ' ' HG3' ' B' ' 60' ' ' GLN . 7.7 p-80 -76.47 -14.92 60.01 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 119.51 -0.876 . . . . 0.0 110.657 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.6 mt -74.57 -37.9 62.83 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 176.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.554 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.1 tm0? -70.29 -33.8 71.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 177.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.46 -51.0 71.71 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.787 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.704 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.89 -38.84 92.51 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.572 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.421 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.3 OUTLIER -56.07 -29.55 60.69 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.269 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -50.07 -26.37 4.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.082 0.468 . . . . 0.0 110.841 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -96.34 -46.29 6.46 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.621 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.704 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -68.54 -21.14 64.57 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 48.0 mtpt -71.63 -27.3 63.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.744 0.307 . . . . 0.0 110.982 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.485 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.66 30.9 4.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.724 0.773 . . . . 0.0 109.649 178.209 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.582 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 12.6 t -96.24 -42.94 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.794 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.498 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 20.3 tt0 -103.32 101.74 11.68 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.13 0.967 . . . . 0.0 111.252 178.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.835 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -176.32 -33.13 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 112.863 -1.971 . . . . 0.0 110.257 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.835 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -117.32 -9.43 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.989 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 178.622 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 63.6 Cg_endo -85.75 168.0 9.73 Favored 'Trans proline' 0 C--N 1.366 1.494 0 CA-C-N 122.572 1.954 . . . . 0.0 113.191 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 31.4 m120 -132.86 175.3 9.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.433 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.51 125.41 7.81 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.213 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 15.93 62.19 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.189 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 25.5 mt . . . . . 0 C--O 1.244 0.786 0 CA-C-O 118.462 -0.78 . . . . 0.0 109.735 179.41 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.533 0 N-CA-C 112.066 -0.414 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.4 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 1.3 mt -65.95 -52.83 38.21 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.02 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.4 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 62.6 Cg_exo -44.03 -41.09 12.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.66 2.24 . . . . 0.0 112.58 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -64.21 -35.09 79.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.144 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 98.6 t -58.12 -55.41 22.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.693 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.474 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.73 -37.1 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.94 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.759 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 49.1 m -66.82 -23.18 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.476 0.655 . . . . 0.0 109.653 178.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.529 ' O ' HG12 ' C' ' 92' ' ' VAL . 49.3 tp -73.96 -32.06 63.3 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.851 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.629 ' HA ' HG13 ' C' ' 92' ' ' VAL . 13.3 mmm-85 -63.27 -37.97 89.33 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.759 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.56 -36.74 79.18 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' C' ' 87' ' ' SER . 81.8 mt-30 -64.13 -33.14 75.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.128 177.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.629 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -75.11 -31.89 25.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.942 179.576 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.436 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 15.8 tp10 -64.64 -36.33 83.91 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.35 -59.75 4.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.522 -1.217 . . . . 0.0 111.322 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.528 HD21 HG11 ' A' ' 19' ' ' VAL . 2.5 tm? -58.93 -40.21 83.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.551 -178.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.675 ' HA ' HG23 ' C' ' 99' ' ' VAL . 12.9 pt20 -69.35 -24.3 63.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.483 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.536 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.13 -28.18 73.49 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.356 -1.097 . . . . 0.0 110.356 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.718 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 78.8 mm-40 -74.43 -46.27 41.06 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.414 178.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.675 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.01 -41.69 93.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.421 -0.511 . . . . 0.0 111.169 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.536 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.3 pt20 -61.87 -43.15 99.43 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.031 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.553 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.2 p-80 -78.55 -14.85 59.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.774 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.3 mt -74.21 -37.91 63.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.2 tm0? -71.08 -34.19 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.13 -51.51 69.42 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.396 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.09 -38.14 90.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.804 178.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.539 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 1.0 OUTLIER -56.32 -29.67 61.59 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 123.451 0.469 . . . . 0.0 111.016 178.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 29.6 t -48.37 -26.94 2.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.107 0.48 . . . . 0.0 111.024 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -96.98 -46.5 6.18 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.909 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 21.5 m-85 -68.48 -20.57 64.61 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.539 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 44.3 mtpt -72.11 -28.1 63.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.606 ' HA ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -101.33 31.51 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.832 0.825 . . . . 0.0 109.84 178.157 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.564 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -96.49 -42.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.956 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.562 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 20.6 tt0 -103.04 100.85 10.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.287 1.042 . . . . 0.0 111.306 178.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.638 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -173.21 -37.5 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 112.794 -2.003 . . . . 0.0 109.847 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.638 ' H ' HD12 ' C' ' 114' ' ' LEU . 0.2 OUTLIER -114.99 -9.96 0.1 OUTLIER Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -179.659 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 67.7 Cg_endo -84.47 168.02 11.61 Favored 'Trans proline' 0 C--N 1.359 1.121 0 CA-C-N 122.512 1.933 . . . . 0.0 113.269 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -133.4 175.36 9.48 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.399 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -89.77 123.22 6.84 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.348 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -92.77 11.3 72.41 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.673 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 26.3 mt . . . . . 0 C--O 1.243 0.718 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.01 179.493 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.986 0 N-CA-C 112.464 -0.255 . . . . 0.0 112.464 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.43 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 3.8 mm? -58.96 -55.08 50.1 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-O 119.253 -0.404 . . . . 0.0 111.788 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.43 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 71.6 Cg_exo -44.17 -44.47 12.61 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 122.878 2.385 . . . . 0.0 112.89 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -37.55 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.249 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.549 HG11 HG22 ' C' ' 85' ' ' VAL . 61.4 t -64.04 -47.86 88.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.464 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -68.41 -29.29 67.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.752 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.59 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 49.2 m -70.02 -22.51 63.09 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.949 0.88 . . . . 0.0 109.391 178.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.2 tp -76.8 -21.72 54.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.513 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.655 ' O ' HG12 ' A' ' 12' ' ' VAL . 7.9 mmm180 -67.56 -33.9 75.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -71.7 -47.12 56.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 179.727 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -64.53 -27.75 69.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.281 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -77.64 -36.92 23.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.766 -178.658 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.499 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.7 mt-10 -69.99 -28.6 65.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.29 -50.93 63.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.341 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.434 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.0 tp -60.79 -39.13 87.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.124 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.499 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 12.2 pt20 -71.42 -23.45 61.86 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.325 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.6 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.34 -28.36 73.31 Favored Glycine 0 C--O 1.24 0.521 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.441 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.678 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.3 mm-40 -73.65 -42.77 60.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.98 0.419 . . . . 0.0 110.005 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.554 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 3.4 t -65.94 -42.58 92.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.159 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.6 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.6 pt20 -62.33 -41.44 98.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.539 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 6.9 p-80 -79.26 -17.38 54.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.806 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.3 mt -71.95 -47.57 51.38 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.718 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 13.2 pt20 -71.36 -22.7 61.86 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -62.21 -51.3 68.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.01 -41.64 99.63 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.548 177.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.718 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -52.03 -29.13 19.73 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.692 178.866 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.4 t -47.67 -33.47 6.89 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.008 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.87 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 69.6 mt-30 -86.73 -51.51 6.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.457 0.646 . . . . 0.0 110.884 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.666 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.3 m-85 -63.94 -21.31 66.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.29 -0.868 . . . . 0.0 113.167 -177.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' CE2' ' C' ' 109' ' ' TYR . 10.4 mmmm -64.63 -32.2 73.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.963 0.411 . . . . 0.0 110.51 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.87 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -108.52 35.91 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.095 0.474 . . . . 0.0 110.763 179.394 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.666 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 5.9 t -95.66 -43.59 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.575 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.444 ' HB2' HG22 ' C' ' 112' ' ' VAL . 33.7 tt0 -104.52 102.35 11.98 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 122.084 0.945 . . . . 0.0 110.551 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.913 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -175.12 -39.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 113.041 -1.89 . . . . 0.0 111.288 -179.254 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.913 ' H ' HD23 ' A' ' 34' ' ' LEU . 4.7 p90 -98.08 -25.73 0.24 Allowed Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.65 ' HD2' ' H ' ' A' ' 34' ' ' LEU . 72.8 Cg_endo -82.3 -177.46 3.49 Favored 'Trans proline' 0 C--N 1.364 1.365 0 CA-C-N 121.169 1.453 . . . . 0.0 112.676 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 39.8 p30 -140.67 164.34 30.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.381 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.7 124.79 3.74 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.094 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.13 -99.81 2.52 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.76 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.277 179.261 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.506 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.067 -0.413 . . . . 0.0 112.067 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.436 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 3.8 mm? -61.04 -54.81 50.55 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-O 119.198 -0.43 . . . . 0.0 111.467 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.436 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 76.4 Cg_exo -44.17 -45.01 12.4 Favored 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 122.987 2.458 . . . . 0.0 112.906 -179.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -61.86 -35.62 78.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.14 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.533 HG11 HG22 ' A' ' 5' ' ' VAL . 60.8 t -65.47 -48.92 81.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.335 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.479 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.53 -29.35 68.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.788 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.613 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.6 m -69.28 -23.97 63.9 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.715 0.769 . . . . 0.0 109.461 178.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.5 tp -76.0 -21.96 56.34 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.642 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.675 ' O ' HG12 ' B' ' 52' ' ' VAL . 8.2 mmm180 -67.07 -33.96 76.64 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -71.68 -47.0 57.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.861 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -64.56 -28.11 69.41 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.062 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.675 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -76.95 -36.82 25.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.953 -178.538 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.519 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 47.8 mt-10 -70.57 -28.1 64.64 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 122.017 0.913 . . . . 0.0 108.551 176.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.22 -51.58 60.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.07 177.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.617 HD11 HG11 ' C' ' 99' ' ' VAL . 25.9 tp -60.19 -40.13 88.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.25 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.519 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 12.7 pt20 -70.68 -23.29 62.46 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.438 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.575 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.43 -29.1 72.96 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.669 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.5 mm100 -73.01 -42.44 63.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.112 0.482 . . . . 0.0 110.062 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.534 ' O ' ' HG2' ' B' ' 63' ' ' GLN . 3.5 t -66.62 -42.11 89.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.344 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.575 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.2 pt20 -62.41 -41.85 98.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.07 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.474 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.76 -17.23 56.13 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.137 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.5 mt -72.98 -46.5 51.93 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.755 ' HA ' ' HB2' ' B' ' 66' ' ' PHE . 12.7 pt20 -71.76 -22.14 61.64 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -62.42 -51.44 67.51 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.625 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.34 -41.68 98.9 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.498 177.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.755 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -51.94 -29.28 19.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.517 179.058 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 41.8 t -47.89 -34.71 9.3 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.862 0.363 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.867 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 66.9 mt-30 -85.45 -50.54 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.2 0.524 . . . . 0.0 110.841 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.689 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 15.9 m-85 -64.89 -20.62 66.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.447 ' HD2' ' CE2' ' A' ' 29' ' ' TYR . 10.2 mmmm -65.05 -32.24 73.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.117 0.484 . . . . 0.0 110.419 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.867 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -108.07 36.74 2.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.6 0.714 . . . . 0.0 110.637 179.08 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.689 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -96.51 -43.2 12.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.549 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.466 ' HB2' HG22 ' A' ' 32' ' ' VAL . 34.4 tt0 -105.11 100.83 10.41 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.031 0.92 . . . . 0.0 110.866 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.906 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -173.11 -39.97 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.404 -1.726 . . . . 0.0 111.29 -179.568 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.906 ' H ' HD23 ' B' ' 74' ' ' LEU . 4.9 p90 -97.33 -24.52 0.23 Allowed Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 178.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.624 ' HD2' ' H ' ' B' ' 74' ' ' LEU . 72.8 Cg_endo -83.03 -177.59 3.41 Favored 'Trans proline' 0 C--N 1.366 1.451 0 CA-C-N 121.317 1.506 . . . . 0.0 112.887 -179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 39.1 p30 -141.84 161.49 37.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.44 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -130.33 127.36 5.27 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.823 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 92.33 -99.97 2.61 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.121 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.444 -0.789 . . . . 0.0 110.422 179.439 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.473 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.488 2.122 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.432 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 3.8 mm? -60.67 -54.77 51.38 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 119.334 -0.365 . . . . 0.0 111.46 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.432 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 67.9 Cg_exo -43.76 -44.72 11.43 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 123.033 2.489 . . . . 0.0 112.913 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -62.14 -36.47 81.89 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.354 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.549 HG22 HG11 ' A' ' 5' ' ' VAL . 73.7 t -65.03 -48.12 85.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.205 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.18 -29.84 68.81 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.832 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.1 m -69.19 -22.76 63.88 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.874 0.845 . . . . 0.0 109.22 178.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.619 ' O ' HG22 ' C' ' 92' ' ' VAL . 67.1 tp -76.15 -23.02 54.78 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.713 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.51 ' HA ' ' CG2' ' C' ' 92' ' ' VAL . 8.5 mmm180 -67.51 -31.88 72.31 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.664 0.745 . . . . 0.0 109.032 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -72.51 -45.2 60.51 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.482 -0.781 . . . . 0.0 108.949 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 64.5 tt0 -65.07 -29.31 70.18 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.257 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.619 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.14 -42.18 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.91 179.181 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.1 mt-10 -65.0 -29.52 70.45 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.13 -52.89 52.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.408 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 16' ' ' GLN . 28.4 tp -60.22 -39.93 88.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.325 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.54 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 13.0 pt20 -71.92 -22.29 61.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.408 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.595 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -69.59 -27.83 72.95 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.655 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 11.2 mm100 -74.63 -44.62 49.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.162 0.506 . . . . 0.0 110.413 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.617 HG11 HD11 ' B' ' 55' ' ' LEU . 0.1 OUTLIER -70.74 -31.96 47.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.124 -179.077 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.595 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.8 pt20 -67.04 -42.45 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.707 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.465 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 7.6 p-80 -77.45 -17.53 58.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.234 -0.986 . . . . 0.0 110.592 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 8.4 mt -71.81 -47.06 55.9 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.706 ' HA ' ' HB2' ' C' ' 106' ' ' PHE . 14.3 pt20 -70.99 -22.75 62.14 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -61.68 -51.99 66.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.639 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.31 -41.64 98.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.706 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -51.77 -29.32 18.42 Favored 'General case' 0 C--O 1.214 -0.781 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.411 178.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 46.4 t -47.75 -34.67 8.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.831 0.348 . . . . 0.0 111.124 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.86 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 69.4 mt-30 -85.23 -50.99 6.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.51 0.672 . . . . 0.0 110.665 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.668 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 16.1 m-85 -64.5 -21.58 66.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.136 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.488 ' HD2' ' CE2' ' B' ' 69' ' ' TYR . 10.4 mmmm -65.16 -30.25 71.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.442 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.86 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -109.75 36.94 2.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.523 0.678 . . . . 0.0 110.446 179.204 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.668 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.8 t -97.22 -43.72 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.663 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.53 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 35.8 tt0 -104.73 100.66 10.3 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.252 1.025 . . . . 0.0 110.725 179.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.657 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.1 OUTLIER -170.51 -46.1 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.491 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.657 ' H ' HD12 ' C' ' 114' ' ' LEU . 4.3 p90 -92.83 -25.67 0.27 Allowed Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.602 ' HD2' ' H ' ' C' ' 114' ' ' LEU . 78.5 Cg_endo -82.71 -177.5 3.43 Favored 'Trans proline' 0 C--N 1.36 1.169 0 CA-C-N 121.516 1.577 . . . . 0.0 112.822 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 39.8 p30 -141.38 162.17 36.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.614 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -130.86 124.07 4.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.259 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 94.79 -100.48 2.58 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.855 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.61 179.081 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.965 0 N-CA-C 111.819 -0.512 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.701 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 3.5 mm? -100.95 -55.25 0.14 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 119.713 -0.184 . . . . 0.0 111.297 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.701 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 6.2 Cg_exo -46.13 -45.31 18.27 Favored 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.29 2.66 . . . . 0.0 113.567 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -64.79 -27.34 68.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.816 -0.175 . . . . 0.0 111.203 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 74.4 t -70.49 -46.2 71.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -71.22 -24.81 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.122 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.656 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -73.49 -18.58 61.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.67 0.748 . . . . 0.0 109.618 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.407 HD22 ' HE ' ' B' ' 49' ' ' ARG . 60.0 tp -79.03 -18.81 52.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.729 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -70.79 -44.33 66.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.219 177.856 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.2 pt20 -70.8 -33.91 71.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.007 0.432 . . . . 0.0 109.946 178.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.9 tt0 -69.86 -31.22 68.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.457 0.646 . . . . 0.0 110.391 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.729 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.4 p -79.3 -31.47 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.154 -179.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 46.3 mt-10 -76.06 -20.47 57.72 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.06 -51.62 30.51 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.284 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.0 tp -63.16 -30.48 71.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.972 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.567 ' HA ' HD21 ' C' ' 95' ' ' LEU . 13.0 tt0 -64.4 -40.49 95.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.53 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.645 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -63.44 -27.39 70.75 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.424 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.6 mm100 -71.51 -42.34 68.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.947 0.403 . . . . 0.0 110.047 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.457 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 2.4 t -70.88 -37.61 69.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.775 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.645 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 15.3 pt20 -64.37 -40.99 96.93 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.818 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.537 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -80.12 -17.48 52.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.316 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.731 HD21 ' HG2' ' B' ' 63' ' ' GLN . 7.0 mt -71.43 -38.44 71.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' C' ' 102' ' ' LEU . 34.4 mt-30 -73.78 -27.5 61.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.7 -56.79 17.42 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.099 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.646 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.33 -43.89 97.76 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.142 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -53.42 -26.09 18.47 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.975 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -53.98 -36.89 63.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 111.446 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.614 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 24.7 pt20 -87.45 -36.48 17.67 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.103 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.741 ' OH ' ' HD2' ' B' ' 70' ' ' LYS . 26.5 m-85 -73.66 -20.41 60.57 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.439 0.638 . . . . 0.0 110.906 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.697 ' HD2' ' OH ' ' C' ' 109' ' ' TYR . 35.2 tptt -64.56 -40.32 95.35 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.172 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.629 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -95.38 31.48 1.96 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.684 0.754 . . . . 0.0 110.524 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.549 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 9.4 t -95.45 -41.27 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.062 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.556 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 16.8 tt0 -102.62 103.45 13.74 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 122.177 0.989 . . . . 0.0 110.464 178.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.787 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -171.8 -32.38 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 112.942 -1.935 . . . . 0.0 110.292 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.787 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -124.59 23.29 0.11 Allowed Pre-proline 0 CA--C 1.554 1.124 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 177.737 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.736 ' HD3' ' H ' ' A' ' 34' ' ' LEU . 61.8 Cg_endo -89.34 -168.16 0.31 Allowed 'Trans proline' 0 C--N 1.367 1.536 0 CA-C-N 121.472 1.561 . . . . 0.0 113.037 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -90.73 28.9 1.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.168 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.18 136.55 17.65 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.143 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.69 132.69 11.06 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.161 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 10.3 tt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.484 -0.769 . . . . 0.0 110.093 179.764 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.669 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 3.5 mm? -97.11 -54.06 0.21 Allowed Pre-proline 0 N--CA 1.466 0.371 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.669 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 5.1 Cg_exo -47.12 -44.78 22.94 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.278 2.652 . . . . 0.0 113.517 -177.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -66.16 -25.03 66.76 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.472 0.177 . . . . 0.0 111.292 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.483 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 82.2 t -72.15 -46.06 59.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.647 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -71.29 -23.92 62.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.025 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.9 m -74.52 -18.56 60.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.6 0.714 . . . . 0.0 109.74 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.493 HD22 ' HE ' ' C' ' 89' ' ' ARG . 61.3 tp -79.36 -18.27 52.79 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.713 ' O ' HG12 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -70.75 -44.27 67.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.212 177.773 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.4 pt20 -70.91 -34.84 71.95 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 40.1 tt0 -68.88 -30.79 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.565 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.713 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.5 p -79.67 -32.23 14.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.233 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 46.1 mt-10 -75.54 -20.17 58.86 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.13 -51.88 27.96 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.156 177.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.582 HD21 ' HB3' ' C' ' 95' ' ' LEU . 23.0 tp -63.09 -30.29 71.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.989 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -64.0 -39.83 94.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.572 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.637 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -64.39 -26.89 71.0 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.733 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.664 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.2 mm100 -72.03 -42.7 66.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.062 0.458 . . . . 0.0 110.0 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.4 t -69.97 -37.96 74.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.782 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.637 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -64.53 -41.76 96.17 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.013 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.53 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.9 p-80 -78.9 -17.32 55.74 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.328 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.723 HD21 ' HG2' ' C' ' 103' ' ' GLN . 7.0 mt -71.88 -38.43 70.02 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' A' ' 22' ' ' LEU . 34.9 mt-30 -73.98 -26.51 60.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -61.07 -55.96 26.5 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.09 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.82 -44.98 94.72 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.042 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -52.46 -25.94 11.46 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.893 179.211 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 28.2 t -54.61 -35.62 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.748 0.249 . . . . 0.0 111.44 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' B' ' 65' ' ' ALA . 24.0 pt20 -88.74 -36.4 16.15 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.039 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.742 ' OH ' ' HD2' ' C' ' 110' ' ' LYS . 27.0 m-85 -73.79 -19.96 60.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.304 0.573 . . . . 0.0 110.761 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.741 ' HD2' ' OH ' ' A' ' 29' ' ' TYR . 32.8 tptt -64.55 -41.23 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.933 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.608 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -94.53 31.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.433 0.635 . . . . 0.0 110.775 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 9.3 t -95.17 -41.68 12.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.931 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.629 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 15.1 tt0 -102.46 103.41 13.79 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 122.24 1.019 . . . . 0.0 110.658 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.799 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -171.63 -33.04 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 112.811 -1.995 . . . . 0.0 110.114 -179.687 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.799 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.1 OUTLIER -123.79 23.39 0.11 Allowed Pre-proline 0 CA--C 1.552 1.045 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.737 ' HD3' ' H ' ' B' ' 74' ' ' LEU . 54.9 Cg_endo -89.06 -167.39 0.28 Allowed 'Trans proline' 0 C--N 1.364 1.388 0 CA-C-N 121.759 1.664 . . . . 0.0 113.052 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -91.01 27.63 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.264 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.94 134.18 13.57 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.447 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -100.22 134.85 11.85 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.124 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.948 -179.952 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.655 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 3.4 mm? -97.92 -55.22 0.19 Allowed Pre-proline 0 C--N 1.324 -0.532 0 O-C-N 122.843 -0.21 . . . . 0.0 111.546 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.655 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 6.8 Cg_exo -46.04 -43.85 19.8 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.229 2.619 . . . . 0.0 113.859 -178.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -66.2 -26.82 67.58 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.493 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 84.9 t -70.93 -46.22 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.62 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -71.84 -24.01 61.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.265 178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 71.1 m -74.9 -18.57 60.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.743 0.783 . . . . 0.0 109.25 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.727 ' O ' HG22 ' C' ' 92' ' ' VAL . 57.0 tp -77.63 -19.3 55.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.62 ' HB2' ' O ' ' C' ' 86' ' ' ALA . 0.2 OUTLIER -71.32 -42.71 68.24 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.649 178.272 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 pt20 -70.95 -33.52 70.55 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 38.8 tt0 -68.82 -33.49 73.92 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.238 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.727 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.82 -38.52 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.913 178.243 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 42.0 mt-10 -68.49 -21.56 64.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.96 -52.54 23.55 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.208 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.582 ' HB3' HD21 ' B' ' 55' ' ' LEU . 0.3 OUTLIER -60.66 -33.52 72.94 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.944 178.128 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -62.66 -40.38 96.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.899 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.543 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -64.87 -27.19 71.81 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.481 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.2 mm100 -71.58 -42.77 67.38 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 178.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.476 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 2.5 t -70.73 -37.17 67.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.543 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.3 pt20 -65.25 -40.74 94.39 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.616 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.568 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.6 p-80 -80.42 -17.5 51.6 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.296 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.689 HD21 ' HG2' ' A' ' 23' ' ' GLN . 7.2 mt -71.13 -38.53 72.28 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.723 ' HG2' HD21 ' B' ' 62' ' ' LEU . 34.4 mt-30 -73.87 -27.21 60.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.51 -56.96 15.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.299 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.638 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.16 -44.45 96.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.155 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -52.92 -26.88 16.36 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.022 179.461 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 34.4 t -53.14 -37.84 62.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.684 0.278 . . . . 0.0 111.194 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' C' ' 105' ' ' ALA . 25.1 pt20 -87.0 -35.9 18.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.368 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.697 ' OH ' ' HD2' ' A' ' 30' ' ' LYS . 28.7 m-85 -74.21 -19.93 60.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.361 0.6 . . . . 0.0 110.85 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.742 ' HD2' ' OH ' ' B' ' 69' ' ' TYR . 32.0 tptt -64.67 -40.8 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.994 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.608 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -95.06 31.71 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.481 0.658 . . . . 0.0 110.753 179.08 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.535 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 10.9 t -95.97 -41.38 11.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.954 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.608 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 15.7 tt0 -102.52 101.69 11.89 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-O 122.459 1.124 . . . . 0.0 111.221 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.712 ' H ' ' HD3' ' C' ' 116' ' ' PRO . 0.2 OUTLIER -167.68 -37.98 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 112.651 -2.068 . . . . 0.0 109.723 -179.531 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.628 ' H ' HD12 ' C' ' 114' ' ' LEU . 0.1 OUTLIER -120.93 23.57 0.11 Allowed Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.712 ' HD3' ' H ' ' C' ' 114' ' ' LEU . 66.3 Cg_endo -88.95 -168.82 0.36 Allowed 'Trans proline' 0 C--N 1.362 1.262 0 CA-C-N 121.782 1.672 . . . . 0.0 113.026 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -89.52 28.2 1.33 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.324 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -78.67 135.53 15.9 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.657 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -102.3 131.6 10.66 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.494 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.706 179.632 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.689 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 2.3 mm? -119.8 -61.59 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.756 0.278 . . . . 0.0 111.023 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.689 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 6.2 Cg_endo -53.27 -49.63 16.8 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.13 2.553 . . . . 0.0 113.31 -177.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -61.75 -33.97 75.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.661 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 HG11 ' B' ' 45' ' ' VAL . 90.1 t -69.42 -50.65 49.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.69 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.636 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.0 -24.84 64.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.289 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 70.7 m -69.66 -26.18 64.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.0 tp -73.59 -23.55 59.95 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.053 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 48.4 mmm-85 -63.45 -23.68 67.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.253 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.0 mt-30 -76.34 -43.21 42.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.522 -179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 52.0 tt0 -70.03 -29.29 66.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.454 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.9 t -74.6 -36.37 40.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.077 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -66.36 -32.12 73.31 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -64.98 -56.73 11.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.283 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 mp -57.7 -39.08 76.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.034 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -70.67 -31.33 68.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.1 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -72.72 -31.14 62.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 119.933 -1.127 . . . . 0.0 111.494 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 14' ' ' ALA . 22.6 mm100 -76.37 -35.52 58.63 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 120.806 0.336 . . . . 0.0 110.575 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.7 t -77.16 -32.03 18.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.729 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.589 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -67.98 -40.12 83.17 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.487 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.526 ' CE1' HD12 ' A' ' 22' ' ' LEU . 6.8 p-80 -80.44 -25.6 38.86 Favored 'General case' 0 N--CA 1.46 0.049 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.928 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.756 HD11 ' HG3' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -72.87 -39.73 66.22 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.863 178.475 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.694 ' HG3' HD21 ' C' ' 102' ' ' LEU . 26.6 tt0 -70.71 -36.86 73.44 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.87 -56.61 19.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.967 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.35 -48.21 82.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.77 179.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.775 ' HD2' HD13 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.54 -24.84 22.53 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.064 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.2 t -49.61 -32.2 12.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.64 0.257 . . . . 0.0 111.04 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.429 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 12.9 mm100 -96.3 -45.63 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.081 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.8 m-85 -66.47 -20.08 65.95 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -73.24 -4.4 32.82 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.908 0.385 . . . . 0.0 110.868 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.609 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -127.76 36.06 4.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.983 0.897 . . . . 0.0 108.73 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.569 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 12.8 t -100.58 -34.63 4.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.127 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -85.62 81.64 8.57 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 122.969 1.366 . . . . 0.0 111.417 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.618 HD12 ' H ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -163.69 -37.3 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 111.95 -2.387 . . . . 0.0 109.539 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.618 ' H ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -120.22 38.85 0.33 Allowed Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 179.045 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 73.4 Cg_endo -75.33 179.63 5.98 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.464 1.443 . . . . 0.0 111.747 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -94.07 65.11 3.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.322 0.582 . . . . 0.0 109.697 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 129.29 -168.34 20.95 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.768 -0.729 . . . . 0.0 111.937 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -147.0 -70.06 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.146 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.155 179.51 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.971 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.676 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 2.3 mm? -117.82 -62.07 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 117.073 0.437 . . . . 0.0 111.342 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.676 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 5.2 Cg_endo -52.06 -49.07 18.56 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 123.337 2.692 . . . . 0.0 113.679 -177.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.21 -31.61 72.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.566 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.416 HG11 HG22 ' A' ' 5' ' ' VAL . 97.7 t -71.3 -50.87 38.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.564 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -68.84 -25.58 64.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.244 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 73.4 m -69.01 -26.22 64.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 55.7 tp -73.1 -23.79 60.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.066 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.654 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 47.8 mmm-85 -63.81 -21.85 66.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.973 0.415 . . . . 0.0 110.215 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.3 mt-30 -77.94 -43.68 29.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.287 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 52.0 tt0 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.622 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 26.7 t -74.85 -37.79 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 88.8 tt0 -65.37 -31.79 73.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' B' ' 58' ' ' GLN . . . -65.35 -56.58 11.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.442 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 59' ' ' VAL . 4.7 mp -57.68 -39.23 76.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.93 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.459 ' HB3' HD21 ' A' ' 15' ' ' LEU . 19.8 pt20 -70.35 -31.95 69.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.087 -179.067 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.582 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -71.98 -30.89 64.98 Favored Glycine 0 C--O 1.238 0.396 0 C-N-CA 120.08 -1.057 . . . . 0.0 111.373 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' B' ' 54' ' ' ALA . 22.5 mm100 -76.58 -36.49 57.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.795 0.331 . . . . 0.0 110.528 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.9 t -76.28 -31.29 20.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 122.256 -0.278 . . . . 0.0 110.711 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -69.02 -40.51 78.62 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.279 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.548 ' CE1' HD12 ' B' ' 62' ' ' LEU . 6.8 p-80 -80.18 -24.97 39.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 119.856 -0.738 . . . . 0.0 111.061 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.673 HD11 ' HG3' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -74.03 -39.5 63.53 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.584 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.756 ' HG3' HD11 ' A' ' 22' ' ' LEU . 23.3 tt0 -69.93 -38.72 76.29 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.57 30.6 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.122 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.722 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.51 -48.03 82.9 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.797 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.692 ' HD2' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.65 -24.39 21.45 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.286 -179.615 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -49.96 -31.88 13.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.772 0.32 . . . . 0.0 110.999 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' B' ' 71' ' ' LYS . 12.8 mm100 -96.83 -44.86 6.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 111.096 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.722 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 14.4 m-85 -67.12 -19.69 65.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -73.57 -4.07 31.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.023 0.439 . . . . 0.0 110.786 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.619 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -127.98 35.89 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.782 0.801 . . . . 0.0 109.012 177.557 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.56 HG23 ' HA ' ' B' ' 69' ' ' TYR . 11.8 t -100.33 -34.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.101 -179.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -84.79 80.89 9.11 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 123.11 1.434 . . . . 0.0 111.402 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.619 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -163.61 -34.5 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 111.978 -2.374 . . . . 0.0 109.926 179.584 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.544 ' H ' HD12 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -123.15 38.59 0.38 Allowed Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 178.866 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 71.8 Cg_endo -75.7 177.5 8.61 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.507 1.471 . . . . 0.0 111.738 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -91.78 67.93 5.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.332 0.587 . . . . 0.0 109.731 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 128.63 -164.36 21.83 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.166 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -151.83 -71.6 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.948 -0.644 . . . . 0.0 111.848 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.184 -0.912 . . . . 0.0 109.684 179.509 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.66 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.665 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 5.5 mt -125.45 -61.71 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.665 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 8.4 Cg_endo -53.09 -46.86 30.88 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.899 2.4 . . . . 0.0 112.808 -179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -63.95 -33.73 76.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.329 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 92.1 t -69.19 -50.99 47.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.7 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.657 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.68 -25.02 64.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.283 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 73.4 m -69.67 -25.75 64.05 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 54.9 tp -73.77 -23.6 59.74 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.984 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.657 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 48.3 mmm-85 -64.21 -21.7 66.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.194 178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 mt-30 -78.45 -43.47 27.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.027 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 51.8 tt0 -69.42 -29.91 67.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.728 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 25.3 t -74.71 -36.14 39.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.819 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.03 -31.27 72.06 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' C' ' 98' ' ' GLN . . . -66.02 -56.42 11.69 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.249 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.604 ' O ' HG23 ' C' ' 99' ' ' VAL . 7.3 mt -57.05 -40.33 76.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.703 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' B' ' 55' ' ' LEU . 20.0 pt20 -70.06 -32.32 70.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.397 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.592 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -71.62 -31.66 65.09 Favored Glycine 0 C--O 1.239 0.451 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.268 178.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' C' ' 94' ' ' ALA . 22.4 mm100 -76.2 -34.91 59.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.674 0.273 . . . . 0.0 110.706 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.604 HG23 ' O ' ' C' ' 95' ' ' LEU . 60.1 t -77.52 -31.46 17.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.697 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -68.71 -38.72 80.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.324 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.59 ' CE1' HD23 ' C' ' 102' ' ' LEU . 6.3 p-80 -81.77 -26.41 34.47 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.604 -0.839 . . . . 0.0 111.097 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.775 HD13 ' HD2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.54 -47.09 70.88 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.712 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.673 ' HG3' HD11 ' B' ' 62' ' ' LEU . 24.2 tt0 -67.51 -38.38 84.21 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.31 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.64 -55.96 25.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.002 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.729 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.01 -47.78 84.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.993 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.646 ' HD2' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -54.93 -24.01 21.66 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.968 -179.432 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.2 t -50.44 -31.04 14.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.638 0.256 . . . . 0.0 110.841 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' C' ' 111' ' ' LYS . 12.8 mm100 -97.58 -46.0 6.19 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.002 178.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.729 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 15.5 m-85 -65.98 -19.98 66.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -72.75 -5.15 35.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.024 0.44 . . . . 0.0 110.856 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.542 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -126.8 35.39 4.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.97 0.891 . . . . 0.0 108.908 177.636 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.594 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -99.4 -34.81 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.236 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -85.19 81.43 8.83 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 123.081 1.42 . . . . 0.0 111.427 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.542 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.3 OUTLIER -163.57 -36.87 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 112.029 -2.35 . . . . 0.0 109.62 179.507 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.526 ' H ' HD12 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -120.76 39.3 0.36 Allowed Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 72.3 Cg_endo -76.28 178.16 7.86 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.623 1.548 . . . . 0.0 111.7 179.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -92.78 67.4 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.557 0.694 . . . . 0.0 109.967 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 128.59 -164.89 21.65 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.188 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.32 -72.59 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.715 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.981 179.389 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.723 -0.551 . . . . 0.0 111.723 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.676 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 93.4 mt -115.78 -56.38 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.665 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.676 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 51.6 Cg_exo -45.48 -46.22 14.77 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 122.812 2.342 . . . . 0.0 113.496 -178.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.61 -29.34 70.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.697 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.677 HG22 HG11 ' B' ' 45' ' ' VAL . 45.3 t -67.78 -47.69 78.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.663 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.8 -27.0 62.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.393 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 66.2 m -71.0 -17.49 62.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.813 0.816 . . . . 0.0 109.247 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.6 tp -78.21 -21.83 49.46 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.485 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.663 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -69.62 -16.65 63.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.46 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.472 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 9.0 mm-40 -77.87 -40.02 41.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.774 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.492 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 35.5 tp60 -73.24 -25.18 60.62 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.014 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.87 -45.92 54.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.8 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -67.53 -26.91 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -63.07 -54.29 40.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.36 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' B' ' 56' ' ' GLN . 13.1 tp -60.86 -32.96 72.37 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.647 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.606 ' HA ' HD11 ' C' ' 95' ' ' LEU . 10.3 tt0 -63.6 -36.42 83.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.33 178.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.21 -31.43 76.94 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.803 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.638 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 71.0 mt-30 -73.98 -47.54 36.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.093 0.473 . . . . 0.0 111.213 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.6 p -66.48 -36.16 76.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -65.78 -44.58 85.35 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.869 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.508 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -75.36 -13.76 60.43 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.368 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -73.58 -34.69 65.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.29 -35.41 77.8 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.41 -50.69 72.18 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.531 178.056 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.79 -42.46 99.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.056 178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.54 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 6.6 m-85 -56.27 -27.28 54.71 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.71 179.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t -54.63 -27.13 37.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.164 0.507 . . . . 0.0 110.606 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 87.4 mm-40 -94.68 -37.6 11.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.607 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 37.7 m-85 -77.98 -18.81 55.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 0.0 111.481 -179.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 4.2 tmtt? -58.04 -49.88 75.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.42 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.729 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER -88.77 39.46 0.92 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.206 1.003 . . . . 0.0 110.501 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.711 HG13 ' HG3' ' B' ' 76' ' ' PRO . 51.4 t -125.1 -10.55 5.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.673 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.582 ' HA ' HG21 ' C' ' 112' ' ' VAL . 10.8 pt-20 -75.45 -35.19 60.95 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -64.22 -76.73 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.862 0.839 . . . . 0.0 112.732 -177.488 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.469 ' H ' ' HB2' ' A' ' 34' ' ' LEU . 42.3 m-85 -32.54 -50.02 0.57 Allowed Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 117.656 2.465 . . . . 0.0 117.656 -176.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.707 ' HG3' HG13 ' C' ' 112' ' ' VAL . 66.2 Cg_endo -75.69 17.12 0.7 Allowed 'Trans proline' 0 N--CA 1.473 0.29 0 C-N-CA 121.818 1.679 . . . . 0.0 114.548 -177.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -101.31 103.67 14.65 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -31.03 78.97 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 121.121 -0.562 . . . . 0.0 113.608 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.09 34.08 9.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.945 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.174 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.024 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.632 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 95.6 mt -114.91 -57.04 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.411 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.834 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.632 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 50.7 Cg_exo -44.8 -46.01 13.09 Favored 'Trans proline' 0 C--N 1.363 1.337 0 C-N-CA 123.099 2.533 . . . . 0.0 113.31 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -63.44 -29.42 70.71 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.638 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.677 HG11 HG22 ' A' ' 5' ' ' VAL . 41.8 t -68.69 -47.49 76.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.659 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.27 -25.84 61.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.34 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 68.2 m -71.74 -17.56 62.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.933 0.873 . . . . 0.0 109.429 178.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 61.4 tp -78.02 -22.68 48.87 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.269 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 0.3 OUTLIER -68.85 -15.57 63.53 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.444 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -79.57 -39.34 31.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.767 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 36.4 tp60 -74.16 -25.04 59.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.833 0.825 . . . . 0.0 109.037 178.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.89 -45.66 54.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.7 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -68.04 -26.58 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -63.89 -52.97 57.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' C' ' 96' ' ' GLN . 13.3 tp -62.11 -32.36 72.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.632 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.576 ' HA ' HD11 ' A' ' 15' ' ' LEU . 9.0 tt0 -64.31 -35.73 81.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.219 178.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.422 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.71 -31.28 77.45 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.84 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.618 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.3 mt-30 -73.88 -47.77 35.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.035 0.445 . . . . 0.0 110.982 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.488 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.5 p -66.27 -36.23 76.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.6 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 17.4 pt20 -65.64 -44.47 86.3 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.664 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.514 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 7.5 p-80 -75.59 -13.46 60.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.651 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.3 mt -74.22 -35.09 63.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -67.79 -35.6 78.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.06 -51.4 69.42 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.508 -1.223 . . . . 0.0 109.378 177.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.724 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.63 -43.41 97.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.884 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.547 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 7.4 m-85 -55.53 -28.24 53.6 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.679 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.7 t -53.66 -27.41 27.32 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.249 0.547 . . . . 0.0 110.775 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.707 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 89.6 mm-40 -94.64 -38.65 10.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.496 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.724 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 36.0 m-85 -77.04 -18.58 58.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.919 0.39 . . . . 0.0 111.675 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.547 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 4.5 tmtt? -58.77 -49.08 78.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.363 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER -89.25 39.65 0.95 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.989 0.899 . . . . 0.0 110.363 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.668 HG13 ' HG3' ' C' ' 116' ' ' PRO . 55.6 t -125.66 -9.87 5.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.734 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.611 ' HG3' HD13 ' B' ' 74' ' ' LEU . 12.1 pt-20 -76.27 -34.24 59.12 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.875 HD22 ' H ' ' B' ' 74' ' ' LEU . 0.2 OUTLIER -65.42 -75.96 0.08 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.909 0.862 . . . . 0.0 112.972 -177.526 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.425 ' H ' ' HB2' ' B' ' 74' ' ' LEU . 42.6 m-85 -33.01 -50.14 0.63 Allowed Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 -176.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.711 ' HG3' HG13 ' A' ' 32' ' ' VAL . 67.8 Cg_endo -76.14 19.21 0.61 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.214 1.943 . . . . 0.0 114.359 -177.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -103.95 104.5 14.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.24 -36.33 92.86 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.209 -178.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 94.72 31.24 7.91 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.546 -0.835 . . . . 0.0 111.582 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.292 -0.861 . . . . 0.0 109.79 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.921 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.682 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 93.1 mt -116.49 -56.24 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.633 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.682 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 52.3 Cg_exo -45.49 -46.5 14.44 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.831 2.354 . . . . 0.0 113.153 -179.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -63.1 -29.44 70.81 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.641 HG22 HG11 ' A' ' 5' ' ' VAL . 40.2 t -68.02 -47.85 77.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.15 -26.27 62.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.464 . . . . 0.0 110.414 178.589 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 70.6 m -70.7 -17.65 62.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.917 0.865 . . . . 0.0 109.415 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.673 ' O ' HG13 ' C' ' 92' ' ' VAL . 53.1 tp -79.23 -22.99 44.03 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.654 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -69.79 -12.56 61.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.459 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.433 ' H ' ' HG2' ' C' ' 90' ' ' GLN . 0.4 OUTLIER -81.62 -37.44 27.57 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.742 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.427 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 34.5 tp60 -75.01 -27.11 59.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.906 177.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.673 HG13 ' O ' ' C' ' 88' ' ' LEU . 1.5 m -75.76 -38.08 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.561 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -68.38 -27.87 66.62 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -63.99 -52.41 59.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.15 178.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.606 HD11 ' HA ' ' A' ' 16' ' ' GLN . 13.1 tp -61.47 -33.46 73.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.738 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.608 ' HA ' HD11 ' B' ' 55' ' ' LEU . 10.6 tt0 -63.54 -35.72 81.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.391 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.5 -31.64 78.31 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.755 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.629 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 64.0 mt-30 -74.05 -47.37 37.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.097 0.475 . . . . 0.0 111.137 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.516 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -66.53 -35.58 75.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.811 -179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 16.4 pt20 -66.35 -44.29 83.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.951 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.7 p-80 -75.88 -13.46 60.27 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.629 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 6.2 mt -72.93 -35.84 67.11 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -67.3 -36.03 80.68 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 176.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -56.46 -51.38 68.64 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.621 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.72 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.23 -42.81 99.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.291 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.577 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 15.6 m-85 -56.05 -27.88 55.21 Favored 'General case' 0 C--O 1.214 -0.816 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.563 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 24.1 t -52.99 -26.45 15.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.151 0.5 . . . . 0.0 110.694 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.75 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 91.2 mm-40 -96.49 -37.75 10.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.72 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 37.0 m-85 -78.32 -18.95 54.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.997 0.427 . . . . 0.0 111.494 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' C' ' 106' ' ' PHE . 3.7 tmtt? -58.79 -47.39 84.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.598 -179.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.75 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.2 OUTLIER -90.47 38.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.095 0.95 . . . . 0.0 110.138 178.885 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.707 HG13 ' HG3' ' A' ' 36' ' ' PRO . 53.6 t -124.48 -10.37 6.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.813 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' B' ' 72' ' ' VAL . 10.4 pt-20 -75.37 -36.4 60.95 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.886 HD22 ' H ' ' C' ' 114' ' ' LEU . 0.2 OUTLIER -63.18 -76.3 0.07 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.979 0.895 . . . . 0.0 113.023 -177.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.446 ' H ' ' HB2' ' C' ' 114' ' ' LEU . 41.4 m-85 -32.67 -50.95 0.61 Allowed Pre-proline 0 N--CA 1.477 0.889 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -176.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.668 ' HG3' HG13 ' B' ' 72' ' ' VAL . 55.7 Cg_endo -74.74 18.34 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.156 1.904 . . . . 0.0 114.708 -177.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -103.59 103.66 13.62 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.6 -33.76 87.53 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 116.118 -0.492 . . . . 0.0 113.347 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 92.2 31.9 8.73 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.141 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.468 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.433 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.879 -0.488 . . . . 0.0 111.879 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.5 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 0.9 OUTLIER -58.46 -54.51 55.28 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.967 0.383 . . . . 0.0 111.208 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 54.0 Cg_exo -45.44 -40.91 17.95 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 122.804 2.336 . . . . 0.0 113.01 -179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -69.58 -22.43 63.53 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.9 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 90.2 t -68.38 -48.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.958 0.409 . . . . 0.0 110.196 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.971 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.99 -25.77 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.832 179.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 67.7 m -71.69 -22.31 61.67 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.463 ' HA ' ' HG2' ' A' ' 11' ' ' GLN . 62.1 tp -78.92 -26.3 43.69 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.799 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.971 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -64.23 -49.0 73.68 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.491 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.4 pt20 -61.99 -48.5 80.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.108 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 8' ' ' LEU . 15.8 pt20 -68.41 -21.24 64.69 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.198 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.36 -34.92 21.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.616 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.9 mt-10 -70.1 -28.03 65.08 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.91 -58.57 5.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.177 178.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -62.01 -36.28 81.07 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.703 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.616 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 3.8 pt20 -71.06 -22.3 62.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.682 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -69.05 -32.8 73.35 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.056 -1.068 . . . . 0.0 110.655 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 54.1 mt-30 -72.65 -49.85 29.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.47 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.708 ' HB ' HG21 ' B' ' 59' ' ' VAL . 2.9 p -67.42 -28.71 43.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.833 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.682 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 13.2 pt20 -67.38 -43.93 80.2 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -77.73 -18.34 56.64 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.139 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 44.9 mt -72.24 -40.27 67.85 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.592 ' HB2' HD11 ' C' ' 102' ' ' LEU . 19.8 tm0? -70.79 -36.85 73.22 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -54.87 41.8 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.098 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.58 -44.39 97.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.402 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.688 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.93 -26.53 36.75 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.422 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -50.15 -24.79 2.98 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.88 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.717 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 99.0 mm-40 -102.27 -41.09 6.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.375 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.5 m-85 -73.28 -19.59 61.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -178.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 26' ' ' PHE . 43.1 mtmt -69.95 -8.86 52.33 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.855 0.359 . . . . 0.0 110.726 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.717 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.81 37.05 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.74 0.781 . . . . 0.0 109.78 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.621 HG23 ' HA ' ' A' ' 29' ' ' TYR . 8.2 t -100.95 -43.27 10.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.134 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.492 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 31.9 tt0 -87.4 88.92 7.81 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 122.613 1.196 . . . . 0.0 111.259 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.587 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -163.1 -39.96 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.552 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.835 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 83.7 m-85 -55.45 -59.87 9.97 Favored Pre-proline 0 N--CA 1.471 0.599 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.881 178.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.835 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 71.4 Cg_endo -85.69 -178.04 2.82 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.42 2.08 . . . . 0.0 111.834 178.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -93.67 94.16 8.43 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.79 -15.1 78.5 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.38 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.74 80.86 1.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.551 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.9 mm . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.253 -0.879 . . . . 0.0 109.796 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.635 ' HA2' HD22 ' C' ' 82' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.861 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.483 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 0.9 OUTLIER -57.81 -54.75 52.1 Favored Pre-proline 0 N--CA 1.469 0.52 0 CA-C-N 117.174 0.487 . . . . 0.0 111.239 179.367 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.483 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 50.1 Cg_exo -45.84 -39.56 19.07 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.568 2.179 . . . . 0.0 112.961 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -70.57 -23.43 62.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.506 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 96.6 t -67.24 -49.38 72.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.35 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.995 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.36 -25.6 61.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.869 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.682 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 66.4 m -71.86 -21.92 61.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.457 ' HA ' ' HG2' ' B' ' 51' ' ' GLN . 62.3 tp -79.29 -26.46 42.3 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.434 177.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.995 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -63.34 -49.46 73.84 Favored 'General case' 0 N--CA 1.461 0.106 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.25 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.5 pt20 -62.21 -48.25 80.82 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.295 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 48' ' ' LEU . 15.9 pt20 -68.21 -21.64 64.84 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 120.145 -0.622 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -34.79 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.607 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 48.4 mt-10 -69.54 -30.13 67.88 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -62.99 -59.12 5.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.521 178.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -61.6 -35.47 77.96 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 4.0 pt20 -71.57 -22.21 61.77 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.769 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.696 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -68.9 -33.97 76.14 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.771 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 55.5 mt-30 -71.48 -48.95 45.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.069 0.461 . . . . 0.0 110.575 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.711 ' HB ' HG11 ' C' ' 99' ' ' VAL . 2.9 p -68.77 -28.05 38.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.814 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 13.3 pt20 -67.7 -43.26 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.439 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -78.31 -19.11 54.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.991 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 50.7 mt -71.55 -40.73 69.84 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.597 ' HB2' HD11 ' A' ' 22' ' ' LEU . 19.4 tm0? -70.29 -37.34 74.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.45 -55.33 35.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.149 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.691 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.18 -44.75 96.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.377 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.696 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.84 -26.5 35.63 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.336 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -48.9 -27.49 3.13 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.984 0.421 . . . . 0.0 110.595 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.758 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 96.7 mm-40 -99.92 -41.14 7.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.725 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.691 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 38.6 m-85 -72.85 -19.83 61.23 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 66' ' ' PHE . 41.5 mtmt -69.5 -8.34 46.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.67 0.271 . . . . 0.0 110.745 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.758 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -129.44 38.12 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.133 0.968 . . . . 0.0 109.782 178.443 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.633 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 10.4 t -101.61 -43.57 10.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.809 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.531 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 31.4 tt0 -87.68 89.38 7.97 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 122.742 1.258 . . . . 0.0 111.314 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.585 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -164.36 -38.73 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.313 -2.221 . . . . 0.0 109.4 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.814 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 84.5 m-85 -56.72 -59.92 10.91 Favored Pre-proline 0 CA--C 1.537 0.463 0 O-C-N 123.469 0.481 . . . . 0.0 110.029 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.814 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 98.0 Cg_endo -86.2 -178.34 2.77 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.613 2.209 . . . . 0.0 112.074 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -93.6 91.58 7.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.71 -16.53 79.03 Favored Glycine 0 CA--C 1.518 0.239 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.097 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.75 79.81 1.64 Allowed Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.362 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.3 mm . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.437 -179.77 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.421 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.635 HD22 ' HA2' ' B' ' 41' ' ' GLY . 13.1 mt -62.47 -53.73 54.99 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.355 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 50.6 Cg_exo -45.75 -38.1 17.02 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.556 2.171 . . . . 0.0 112.52 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -72.03 -23.12 61.33 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.898 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 84.7 t -66.65 -48.65 79.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.939 0.4 . . . . 0.0 109.994 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 1.04 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.62 -25.24 61.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.845 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 64.2 m -72.48 -21.21 61.25 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.48 ' HA ' ' HG2' ' C' ' 91' ' ' GLN . 63.4 tp -79.9 -26.3 40.27 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.626 177.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 1.04 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.7 OUTLIER -64.23 -48.14 76.95 Favored 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.5 pt20 -63.5 -47.7 80.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.931 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' C' ' 88' ' ' LEU . 16.1 pt20 -69.21 -20.51 63.98 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 119.999 -0.68 . . . . 0.0 111.0 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.05 -34.68 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.604 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.4 mt-10 -69.86 -30.32 67.76 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -61.58 -59.8 4.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.088 -1.415 . . . . 0.0 110.092 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.69 -38.81 89.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.455 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.662 ' HA ' HG23 ' C' ' 99' ' ' VAL . 3.7 pt20 -66.64 -22.1 66.11 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.564 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -68.6 -32.95 75.38 Favored Glycine 0 C--O 1.24 0.473 0 C-N-CA 120.084 -1.055 . . . . 0.0 110.753 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.793 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 25.4 mt-30 -72.04 -46.97 54.99 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.711 HG11 ' HB ' ' B' ' 59' ' ' VAL . 0.2 OUTLIER -64.77 -37.55 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.125 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 14.6 pt20 -62.34 -42.14 99.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -177.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -80.48 -17.83 50.45 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.44 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 48.4 mt -73.53 -40.49 63.96 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.557 ' HB2' HD11 ' B' ' 62' ' ' LEU . 20.1 tm0? -71.1 -37.57 72.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.88 28.53 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.043 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.85 -44.08 97.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.46 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.693 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -55.0 -25.23 28.53 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.596 -179.82 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 32.0 t -51.33 -26.23 7.25 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.09 0.471 . . . . 0.0 110.887 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.724 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 99.2 mm-40 -100.72 -40.76 7.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.321 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.756 ' HA ' HG13 ' C' ' 112' ' ' VAL . 39.5 m-85 -73.1 -19.21 61.2 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' C' ' 106' ' ' PHE . 43.9 mtmt -69.53 -8.88 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.652 0.263 . . . . 0.0 110.435 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.724 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -127.85 34.41 4.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.599 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.756 HG13 ' HA ' ' C' ' 109' ' ' TYR . 0.8 OUTLIER -103.44 -35.03 3.6 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.399 177.759 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 31.3 tt0 -85.85 87.24 7.38 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.849 1.309 . . . . 0.0 110.454 178.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.601 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER -164.82 -38.81 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 112.14 -2.3 . . . . 0.0 109.313 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.828 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 83.5 m-85 -56.42 -59.63 11.52 Favored Pre-proline 0 N--CA 1.468 0.458 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 67.9 Cg_endo -86.51 -179.35 3.02 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.49 2.127 . . . . 0.0 112.042 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -92.39 92.93 8.34 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.63 -16.74 77.03 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.98 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.39 82.25 1.39 Allowed Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.706 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 39.6 mm . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.336 -179.7 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.532 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 91.1 mt -56.92 -55.91 38.78 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 6.1 Cg_exo -46.31 -44.69 19.88 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.258 2.638 . . . . 0.0 113.1 -178.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -66.3 -41.46 89.72 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.094 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 1' ' ' GLY . 91.1 t -64.36 -41.92 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.58 -29.52 68.9 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.681 179.081 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.0 m -67.03 -23.41 65.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.394 0.616 . . . . 0.0 109.736 178.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.576 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 68.0 tp -79.39 -24.66 42.45 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.449 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 12.7 mmm-85 -71.83 -33.69 68.7 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -75.19 -42.61 55.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.379 179.093 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 7' ' ' SER . 97.3 mm-40 -65.2 -32.8 74.66 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.401 0.619 . . . . 0.0 110.308 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -77.91 -26.94 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.172 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -69.55 -30.62 68.47 Favored 'General case' 0 C--O 1.227 -0.091 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.14 -51.41 46.39 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.69 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 52.1 mt -58.7 -31.92 68.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.073 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.444 ' HA ' HG12 ' A' ' 19' ' ' VAL . 21.1 tt0 -70.6 -48.26 56.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.711 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -59.61 -29.69 67.36 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.602 -0.809 . . . . 0.0 111.435 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -73.35 -50.51 21.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.045 0.45 . . . . 0.0 111.065 179.579 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.444 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.5 p -67.62 -31.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.5 pt20 -70.45 -41.53 72.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.811 -0.177 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -78.07 -18.31 55.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.239 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 15.3 mt -71.19 -40.29 71.31 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.001 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.465 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.4 OUTLIER -71.14 -34.01 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.68 31.44 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.296 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.669 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.96 -39.08 93.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.479 178.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -55.73 -26.49 45.71 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.516 179.459 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.9 t -50.2 -32.54 16.69 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.225 0.536 . . . . 0.0 110.371 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.781 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 16.2 mm100 -87.88 -53.69 4.62 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.342 177.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 14.1 m-85 -60.7 -20.59 61.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 14.7 mttp -66.11 -35.35 80.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.497 0.189 . . . . 0.0 110.822 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -100.35 33.17 2.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.232 0.539 . . . . 0.0 110.825 179.591 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.663 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 67.5 t -97.24 -43.97 12.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.708 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' C' ' 112' ' ' VAL . 7.0 tt0 -119.74 105.48 11.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.315 1.055 . . . . 0.0 109.583 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -167.97 -33.93 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.007 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.765 ' CD1' ' HD3' ' A' ' 36' ' ' PRO . 7.2 p90 -79.9 -37.85 1.14 Allowed Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.678 177.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.765 ' HD3' ' CD1' ' A' ' 35' ' ' PHE . 22.7 Cg_endo -95.87 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 122.376 2.051 . . . . 0.0 111.181 178.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -150.57 81.79 1.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.37 -128.46 27.63 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.244 -178.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -166.99 -90.09 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.697 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.8 tt . . . . . 0 C--O 1.245 0.836 0 CA-C-O 118.558 -0.734 . . . . 0.0 109.651 178.976 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.475 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 112.196 -0.362 . . . . 0.0 112.196 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.544 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 89.1 mt -57.62 -55.53 43.77 Favored Pre-proline 0 N--CA 1.464 0.264 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 6.0 Cg_exo -46.77 -45.42 20.3 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.081 2.52 . . . . 0.0 113.07 -178.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.51 -40.44 93.0 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.475 HG23 ' O ' ' B' ' 41' ' ' GLY . 85.6 t -65.21 -42.15 93.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.666 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.87 -29.15 68.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.811 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.678 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 53.7 m -67.29 -23.33 65.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.42 0.628 . . . . 0.0 109.847 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.569 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 66.8 tp -79.57 -24.6 41.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.295 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.666 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 13.2 mmm-85 -71.62 -33.44 68.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.678 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -75.8 -41.81 51.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.425 179.221 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 47' ' ' SER . 97.2 mm-40 -65.57 -33.42 75.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.563 0.697 . . . . 0.0 110.083 178.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.569 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 0.3 OUTLIER -76.99 -27.07 16.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.261 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -69.58 -31.35 69.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -67.6 -50.72 56.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.077 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 52.6 mt -59.04 -32.47 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.967 179.482 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.43 ' HA ' HG12 ' B' ' 59' ' ' VAL . 22.6 tt0 -70.26 -48.0 58.78 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.715 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.97 -29.13 67.29 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.515 -0.85 . . . . 0.0 111.653 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.75 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.8 OUTLIER -74.03 -50.05 21.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.936 0.398 . . . . 0.0 110.96 179.453 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' B' ' 56' ' ' GLN . 14.8 p -67.84 -31.8 53.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 122.131 -0.356 . . . . 0.0 111.902 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.6 pt20 -70.23 -41.74 73.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.779 -0.192 . . . . 0.0 110.836 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -78.17 -18.38 55.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.762 -0.775 . . . . 0.0 110.463 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 16.5 mt -71.41 -39.16 71.29 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.455 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.85 -33.72 68.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.448 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.51 -55.19 38.03 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.3 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.654 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.41 -39.21 93.88 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.354 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.521 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -55.95 -26.13 46.6 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.457 179.329 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -50.74 -31.78 17.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.201 0.524 . . . . 0.0 110.226 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.754 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 15.9 mm100 -88.09 -53.51 4.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.413 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.654 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 13.2 m-85 -60.97 -20.95 63.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 14.7 mttp -65.66 -36.08 82.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.877 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.754 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -99.6 33.11 2.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.481 0.658 . . . . 0.0 110.989 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.648 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 62.5 t -96.82 -43.55 12.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.789 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -120.29 105.61 11.09 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.301 1.048 . . . . 0.0 109.733 176.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.705 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.2 OUTLIER -168.65 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 112.771 -2.013 . . . . 0.0 108.686 -178.632 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.771 ' CD1' ' HD3' ' B' ' 76' ' ' PRO . 6.5 p90 -78.87 -38.95 1.45 Allowed Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.508 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.771 ' HD3' ' CD1' ' B' ' 75' ' ' PHE . 23.7 Cg_endo -96.22 -159.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 122.594 2.196 . . . . 0.0 111.191 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -145.98 83.65 1.64 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.49 -131.27 32.13 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.261 -178.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -163.92 -89.34 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.884 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 5.6 tt . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.13 179.432 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.442 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 112.246 -0.341 . . . . 0.0 112.246 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.535 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 89.2 mt -55.18 -55.74 36.09 Favored Pre-proline 0 N--CA 1.466 0.352 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 6.0 Cg_exo -46.67 -45.28 20.22 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.055 2.503 . . . . 0.0 112.986 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -65.66 -41.89 91.99 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.061 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.442 HG23 ' O ' ' C' ' 81' ' ' GLY . 88.0 t -63.82 -42.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.77 -29.42 68.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.924 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 54.4 m -67.05 -23.78 65.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.471 0.653 . . . . 0.0 109.524 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.631 ' O ' HG22 ' C' ' 92' ' ' VAL . 66.9 tp -78.15 -25.6 47.38 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.78 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.599 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 10.2 mmm-85 -72.5 -31.14 65.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -76.26 -40.81 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.474 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 87' ' ' SER . 97.4 mm-40 -65.82 -34.45 78.18 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.631 HG22 ' O ' ' C' ' 88' ' ' LEU . 1.1 m -74.59 -28.99 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.468 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -65.94 -32.44 73.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.53 -52.53 37.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.912 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.409 HD21 ' HB2' ' A' ' 16' ' ' GLN . 0.3 OUTLIER -56.75 -34.44 67.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.119 178.929 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.443 ' HA ' HG12 ' C' ' 99' ' ' VAL . 22.0 tt0 -69.68 -48.07 60.99 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.655 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -59.39 -29.62 66.6 Favored Glycine 0 C--O 1.237 0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.545 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.739 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 0.7 OUTLIER -74.17 -50.44 19.29 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.406 -0.397 . . . . 0.0 111.047 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.9 p -67.5 -31.88 54.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 17.0 pt20 -70.02 -42.3 73.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.942 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -77.58 -18.1 57.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.589 -0.845 . . . . 0.0 110.253 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.6 mt -71.26 -39.57 71.51 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.586 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.7 OUTLIER -71.1 -34.99 71.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.27 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.89 -56.07 26.36 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.425 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.658 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.7 -38.28 89.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.584 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.514 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.89 -26.12 58.26 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.439 179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.1 t -50.37 -32.66 18.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.095 0.474 . . . . 0.0 109.951 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.773 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 15.9 mm100 -87.68 -53.02 5.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.645 177.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.665 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 13.2 m-85 -61.6 -20.54 63.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 14.5 mttp -65.91 -36.06 82.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.635 0.255 . . . . 0.0 110.686 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -99.3 33.03 2.54 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.157 0.503 . . . . 0.0 111.055 179.241 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.665 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 60.0 t -96.94 -43.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.852 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.401 ' HB2' ' CG2' ' B' ' 72' ' ' VAL . 6.4 tt0 -120.47 105.66 11.08 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 122.45 1.119 . . . . 0.0 109.741 176.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.694 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -168.35 -34.27 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 112.783 -2.008 . . . . 0.0 108.84 -178.925 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.783 ' CD1' ' HD3' ' C' ' 116' ' ' PRO . 6.4 p90 -78.82 -39.21 1.5 Allowed Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.603 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.783 ' HD3' ' CD1' ' C' ' 115' ' ' PHE . 21.1 Cg_endo -95.56 -159.0 0.05 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 122.403 2.069 . . . . 0.0 111.334 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -146.57 84.22 1.62 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 65.24 -129.99 34.88 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.425 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.21 -91.37 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.956 -0.64 . . . . 0.0 111.733 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.342 179.288 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 3' ' ' PRO . 3.2 tm? -60.7 -53.42 64.5 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.366 -0.349 . . . . 0.0 110.751 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 2' ' ' LEU . 78.4 Cg_exo -42.32 -44.72 7.91 Favored 'Trans proline' 0 C--N 1.363 1.314 0 C-N-CA 123.135 2.556 . . . . 0.0 113.197 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.21 -43.92 97.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.638 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 1' ' ' GLY . 46.6 t -61.58 -47.3 93.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.062 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.738 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.12 -24.17 65.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.282 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -68.04 -29.01 67.89 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-O 121.721 0.772 . . . . 0.0 109.125 178.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 51.1 tp -75.75 -22.4 56.54 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.152 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.738 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 41.3 mmm-85 -65.77 -37.58 86.72 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.03 -43.79 81.9 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.656 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.9 tt0 -63.6 -31.3 72.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.89 0.852 . . . . 0.0 109.61 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.55 -28.91 29.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.769 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.579 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 58.0 mt-10 -68.15 -29.47 68.36 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.01 -55.4 12.76 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.314 177.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.9 mm? -59.8 -36.84 77.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.827 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HA ' HG12 ' A' ' 19' ' ' VAL . 10.4 pt20 -75.13 -26.83 59.48 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.181 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.497 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.63 -33.49 76.4 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 177.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 93.1 mm-40 -70.76 -48.62 53.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.837 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 16' ' ' GLN . 6.1 p -67.43 -33.96 65.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.497 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 5.8 pt20 -66.6 -45.7 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.941 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.498 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.9 p-80 -74.57 -17.52 60.71 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 119.736 -0.786 . . . . 0.0 110.433 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.8 mt -72.05 -37.8 69.6 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.706 ' HG2' HD21 ' C' ' 102' ' ' LEU . 74.1 mt-30 -70.88 -30.38 66.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.43 -59.19 5.52 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.465 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.503 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.43 -39.68 91.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.117 178.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -56.27 -26.61 52.41 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -59.22 -28.18 66.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.822 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.644 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 14.5 mm100 -89.59 -33.87 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.561 ' CE1' ' HB3' ' B' ' 73' ' ' GLU . 21.6 m-85 -78.45 -18.4 54.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.581 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.491 ' HA ' ' OH ' ' C' ' 109' ' ' TYR . 8.5 tmtt? -55.47 -46.73 76.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.303 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.756 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -91.13 37.29 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.408 0.623 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.691 HG11 HG12 ' B' ' 72' ' ' VAL . 96.2 t -121.19 3.85 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.97 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.56 ' HB3' ' CE1' ' C' ' 109' ' ' TYR . 9.5 pt-20 -93.85 -27.63 16.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 O-C-N 121.681 -0.637 . . . . 0.0 112.288 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.633 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -54.99 -27.27 42.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.479 0.657 . . . . 0.0 110.499 179.422 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.956 ' HB3' ' HD2' ' A' ' 36' ' ' PRO . 43.2 m-85 -55.61 179.33 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.404 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.956 ' HD2' ' HB3' ' A' ' 35' ' ' PHE . 38.6 Cg_endo -67.47 174.61 7.07 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.627 2.218 . . . . 0.0 113.634 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -104.58 143.65 32.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.897 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.503 ' HA3' ' CD1' ' C' ' 114' ' ' LEU . . . -95.1 -65.99 0.99 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.461 -0.876 . . . . 0.0 111.566 179.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.467 ' H ' ' HB2' ' C' ' 111' ' ' LYS . . . -93.28 -76.93 1.35 Allowed Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.243 0.725 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.424 178.346 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.431 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.987 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.529 ' HB3' ' HD3' ' B' ' 43' ' ' PRO . 3.2 tm? -60.32 -53.35 65.66 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.491 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 43' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 42' ' ' LEU . 64.4 Cg_exo -42.37 -44.72 8.02 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 123.161 2.574 . . . . 0.0 113.323 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.54 -43.34 99.06 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.484 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.431 HG23 ' O ' ' B' ' 41' ' ' GLY . 46.0 t -61.92 -47.25 94.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.875 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.34 -23.65 65.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.157 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.648 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 68.1 m -68.38 -28.41 67.08 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.856 0.836 . . . . 0.0 109.35 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.61 -22.54 54.04 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.885 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 41.7 mmm-85 -65.25 -38.59 90.8 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -66.58 -43.8 83.95 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.048 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 38.6 tt0 -62.96 -31.87 73.07 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.983 0.897 . . . . 0.0 109.377 178.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -29.58 32.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.841 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' GLU . . . . . 0.567 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 54.9 mt-10 -67.45 -28.37 67.82 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.01 -55.69 10.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.18 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' B' ' 55' ' ' LEU . 3.0 mm? -59.27 -37.46 77.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.739 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.568 ' HA ' HG12 ' B' ' 59' ' ' VAL . 9.4 pt20 -74.43 -27.36 60.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.487 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.507 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.7 -32.78 74.74 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.748 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 94.4 mm-40 -70.65 -49.2 49.89 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 121.017 0.437 . . . . 0.0 111.011 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.568 HG12 ' HA ' ' B' ' 56' ' ' GLN . 5.7 p -67.2 -33.95 66.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.507 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 6.0 pt20 -66.41 -45.6 79.38 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.119 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.505 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 7.3 p-80 -74.62 -17.76 60.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.451 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.8 mt -71.93 -38.46 69.85 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 73.7 mt-30 -70.23 -30.95 68.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.21 -58.13 9.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.722 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.526 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.05 -40.0 94.28 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.082 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.55 -25.9 53.38 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.083 -179.849 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -59.71 -28.92 67.74 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.639 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' GLN . . . . . 0.686 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 14.5 mm100 -89.07 -33.35 17.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.753 0.311 . . . . 0.0 111.007 179.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.526 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.8 m-85 -78.84 -17.48 55.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.694 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.502 ' HA ' ' OH ' ' A' ' 29' ' ' TYR . 8.7 tmtt? -56.31 -47.32 78.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.377 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.739 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.5 OUTLIER -90.09 37.23 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.184 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.691 HG12 HG11 ' A' ' 32' ' ' VAL . 99.4 t -120.84 2.63 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.074 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.561 ' HB3' ' CE1' ' A' ' 29' ' ' TYR . 9.5 pt-20 -93.02 -26.76 17.37 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.599 -0.688 . . . . 0.0 112.194 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.649 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -55.36 -26.54 41.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.363 0.601 . . . . 0.0 110.295 179.678 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.945 ' HB3' ' HD2' ' B' ' 76' ' ' PRO . 42.0 m-85 -56.23 178.67 0.13 Allowed Pre-proline 0 CA--C 1.546 0.799 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.482 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.945 ' HD2' ' HB3' ' B' ' 75' ' ' PHE . 37.9 Cg_endo -66.92 175.56 5.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.464 2.109 . . . . 0.0 113.391 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -105.17 143.13 33.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.691 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' GLY . . . . . 0.427 ' HA3' ' HG ' ' A' ' 34' ' ' LEU . . . -94.81 -63.08 1.01 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.638 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.463 ' H ' ' HB2' ' A' ' 31' ' ' LYS . . . -96.49 -75.59 1.26 Allowed Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.245 0.86 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.298 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.4 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.2 -0.36 . . . . 0.0 112.2 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.535 ' HB3' ' HD3' ' C' ' 83' ' ' PRO . 3.3 tm? -59.68 -53.11 68.87 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.733 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.535 ' HD3' ' HB3' ' C' ' 82' ' ' LEU . 69.4 Cg_exo -42.68 -44.16 8.71 Favored 'Trans proline' 0 C--N 1.363 1.298 0 C-N-CA 123.1 2.533 . . . . 0.0 113.36 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -63.05 -43.33 98.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.671 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.4 HG23 ' O ' ' C' ' 81' ' ' GLY . 47.0 t -62.01 -46.29 96.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.855 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.704 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.59 -25.97 66.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.196 179.571 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.638 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 66.7 m -66.64 -28.56 68.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.745 0.783 . . . . 0.0 109.237 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.676 ' O ' HG13 ' C' ' 92' ' ' VAL . 46.5 tp -75.76 -25.07 56.16 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.116 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.704 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 34.8 mmm-85 -65.43 -35.88 82.25 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.638 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.34 -43.26 82.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.364 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -63.6 -32.43 73.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.75 178.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.676 HG13 ' O ' ' C' ' 88' ' ' LEU . 6.0 m -74.91 -23.05 17.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.879 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 93' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 55.8 mt-10 -67.96 -29.81 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.46 -55.1 11.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.135 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.4 mm? -59.1 -37.92 78.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.685 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.62 ' HA ' HG23 ' C' ' 99' ' ' VAL . 10.2 pt20 -73.78 -28.03 61.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.412 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.435 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -67.09 -33.07 82.28 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.736 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 92.6 mm-40 -70.15 -47.26 62.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.159 -0.52 . . . . 0.0 110.422 178.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.62 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.735 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' C' ' 101' ' ' HIS . 10.5 pt20 -59.7 -44.84 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.455 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.529 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.2 p-80 -76.83 -18.82 58.15 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.504 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.2 mt -70.93 -38.24 72.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.704 ' HG2' HD21 ' B' ' 62' ' ' LEU . 72.9 mt-30 -72.08 -30.07 64.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.96 -57.7 11.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.468 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.532 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.62 -40.3 96.54 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.828 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.434 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.15 -25.82 47.87 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.346 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 13.1 t -60.28 -27.83 67.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 0.0 110.72 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 108' ' ' GLN . . . . . 0.678 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 14.6 mm100 -89.75 -32.69 16.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.828 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.56 ' CE1' ' HB3' ' A' ' 33' ' ' GLU . 22.1 m-85 -79.17 -18.29 53.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.664 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.495 ' HA ' ' OH ' ' B' ' 69' ' ' TYR . 9.0 tmtt? -55.46 -47.33 76.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.62 -179.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.788 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.4 OUTLIER -90.12 38.08 0.92 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.419 0.628 . . . . 0.0 111.111 179.626 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.686 HG12 HG11 ' B' ' 72' ' ' VAL . 92.7 t -122.15 2.66 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.339 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' B' ' 69' ' ' TYR . 9.8 pt-20 -92.04 -29.55 16.52 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.355 -0.841 . . . . 0.0 112.452 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.544 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.1 OUTLIER -53.88 -24.3 15.52 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 124.033 0.933 . . . . 0.0 110.539 178.939 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 1.019 ' HB3' ' HD2' ' C' ' 116' ' ' PRO . 43.2 m-85 -61.07 -178.87 0.19 Allowed Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.618 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 1.019 ' HD2' ' HB3' ' C' ' 115' ' ' PHE . 37.6 Cg_endo -67.17 176.76 4.31 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.361 2.04 . . . . 0.0 113.269 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -106.23 143.14 34.78 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.825 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -93.75 -66.51 1.05 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.249 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 119' ' ' GLY . . . . . 0.439 ' H ' ' HB2' ' B' ' 71' ' ' LYS . . . -94.27 -73.91 1.23 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.537 -0.84 . . . . 0.0 111.074 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.242 0.698 0 CA-C-O 118.592 -0.718 . . . . 0.0 109.319 178.668 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.185 -0.366 . . . . 0.0 112.185 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.2 mp -57.73 -54.74 52.15 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 119.109 -0.472 . . . . 0.0 111.804 179.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -44.36 -42.02 13.65 Favored 'Trans proline' 0 C--N 1.362 1.269 0 C-N-CA 122.726 2.284 . . . . 0.0 112.884 -179.335 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -64.59 -37.28 87.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.074 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 45' ' ' VAL . 44.4 t -66.05 -41.04 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.452 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.53 -34.95 74.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.312 0.577 . . . . 0.0 109.681 178.915 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.9 m -71.9 -19.54 61.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.987 0.898 . . . . 0.0 108.695 177.398 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.556 ' O ' HG23 ' A' ' 12' ' ' VAL . 36.6 tp -72.62 -28.05 62.52 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.442 179.663 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 29.8 mmm-85 -62.42 -22.71 66.39 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.975 179.075 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.2 mt-30 -74.28 -35.66 63.76 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.84 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 99.0 mm-40 -71.53 -25.53 62.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 178.16 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.558 HG13 HD11 ' C' ' 95' ' ' LEU . 60.1 t -75.42 -40.26 42.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.367 178.684 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -62.17 -33.55 74.74 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.73 -55.17 18.76 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 113.974 -1.466 . . . . 0.0 110.772 178.394 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.584 HD11 HG13 ' B' ' 52' ' ' VAL . 78.8 mt -55.11 -45.18 75.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.719 -179.334 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 14.1 pt20 -72.66 -25.2 61.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 -179.553 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.75 -31.78 76.63 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 177.552 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.669 ' HB3' HG11 ' B' ' 59' ' ' VAL . 14.1 mm100 -71.51 -40.34 70.21 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.112 178.392 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' C' ' 98' ' ' GLN . 2.9 t -67.12 -44.98 87.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.523 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.7 pt20 -61.47 -43.09 99.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.678 -178.548 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.1 p-80 -77.75 -17.63 57.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.175 -179.667 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.671 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.2 mp -77.12 -35.54 56.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 120.099 -0.641 . . . . 0.0 109.56 178.518 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HG2' HD21 ' C' ' 102' ' ' LEU . 34.2 mt-30 -74.97 -30.63 61.25 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.29 -53.9 53.04 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.229 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.68 -46.71 86.65 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.508 178.273 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.407 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -47.88 -33.1 7.04 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 123.86 0.725 . . . . 0.0 112.502 179.558 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t -53.96 -34.01 58.53 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.853 0.358 . . . . 0.0 111.582 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -86.05 -12.77 49.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.865 0.364 . . . . 0.0 111.522 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.768 ' O ' HG22 ' A' ' 32' ' ' VAL . 62.4 m-85 -103.74 -16.03 15.56 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.348 0.594 . . . . 0.0 109.509 179.347 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.605 ' HA ' ' HE2' ' C' ' 109' ' ' TYR . 82.5 mttt -63.49 -17.74 63.07 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.443 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.597 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -102.25 22.82 12.65 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.563 179.03 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.768 HG22 ' O ' ' A' ' 29' ' ' TYR . 4.3 m -119.06 -14.72 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 121.838 -0.539 . . . . 0.0 111.964 179.745 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.482 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 10.7 pt-20 -75.43 -28.63 59.44 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.481 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.597 HD11 ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -91.53 -41.61 10.71 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -175.093 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 4.6 m-30 -45.85 -63.77 1.15 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 123.806 0.691 . . . . 0.0 111.35 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 96.2 Cg_endo -81.34 171.93 13.19 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.458 2.106 . . . . 0.0 111.369 178.692 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -117.34 -89.41 0.58 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.76 179.443 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.705 ' HA3' ' HZ ' ' C' ' 115' ' ' PHE . . . 69.22 61.8 4.32 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.849 -0.691 . . . . 0.0 111.702 -179.843 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 87.12 -98.24 2.35 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.211 -178.918 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.7 pt . . . . . 0 C--O 1.245 0.849 0 CA-C-O 118.506 -0.759 . . . . 0.0 110.461 179.227 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 41' ' ' GLY . . . . . 0.415 ' HA2' HD22 ' C' ' 82' ' ' LEU . . . . . . . . 0 N--CA 1.486 1.968 0 N-CA-C 112.606 -0.197 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mp -55.73 -55.01 45.35 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-O 119.279 -0.391 . . . . 0.0 112.046 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -44.26 -43.23 13.37 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.87 2.38 . . . . 0.0 112.571 -179.308 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -63.52 -37.68 88.25 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.88 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.722 HG11 HG22 ' A' ' 5' ' ' VAL . 45.0 t -66.12 -40.7 87.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.212 179.444 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -69.77 -35.73 75.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.486 178.886 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 47' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 32.8 m -69.99 -19.95 63.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.089 0.947 . . . . 0.0 108.63 177.159 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 48' ' ' LEU . . . . . 0.515 ' O ' HG23 ' B' ' 52' ' ' VAL . 33.4 tp -72.29 -28.92 63.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 49' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 31.5 mmm-85 -61.26 -24.14 66.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.949 179.014 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 50' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' B' ' 47' ' ' SER . 5.5 mt-30 -72.67 -36.74 67.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.984 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 98.9 mm-40 -70.45 -26.13 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.496 178.108 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.584 HG13 HD11 ' A' ' 15' ' ' LEU . 57.7 t -74.73 -40.72 47.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.357 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.88 -33.75 74.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.573 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 54' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.21 -55.04 20.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.916 178.273 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 55' ' ' LEU . . . . . 0.534 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -55.53 -44.98 77.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.653 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 56' ' ' GLN . . . . . 0.487 ' O ' ' HG2' ' B' ' 60' ' ' GLN . 13.9 pt20 -72.83 -24.94 60.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 57' ' ' GLY . . . . . 0.502 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.19 -30.9 73.95 Favored Glycine 0 C--O 1.237 0.302 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.705 ' HB3' HG21 ' C' ' 99' ' ' VAL . 14.1 mm100 -72.02 -41.75 67.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.168 -0.516 . . . . 0.0 109.933 178.433 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.669 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.9 t -65.42 -46.21 90.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.402 179.921 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 60' ' ' GLN . . . . . 0.502 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 8.9 pt20 -60.58 -43.01 97.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.762 -178.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 61' ' ' HIS . . . . . 0.489 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.1 p-80 -78.28 -16.82 57.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 62' ' ' LEU . . . . . 0.657 ' HG ' ' HE2' ' C' ' 106' ' ' PHE . 1.2 mp -77.56 -36.29 52.32 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.402 178.453 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.671 ' HG2' HD11 ' A' ' 22' ' ' LEU . 34.4 mt-30 -73.79 -31.49 63.3 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 64' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.1 -54.4 47.17 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.689 177.111 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 65' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' B' ' 69' ' ' TYR . . . -58.27 -47.12 84.61 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.3 178.413 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 66' ' ' PHE . . . . . 0.641 ' HE2' ' HG ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -47.58 -33.09 6.12 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 123.838 0.711 . . . . 0.0 112.682 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -54.58 -33.85 60.96 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 0.0 111.524 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -86.03 -12.22 50.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.912 0.387 . . . . 0.0 111.472 179.371 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 69' ' ' TYR . . . . . 0.789 ' O ' HG22 ' B' ' 72' ' ' VAL . 61.9 m-85 -104.05 -16.67 15.22 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.494 0.664 . . . . 0.0 109.327 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 29' ' ' TYR . 83.5 mttt -62.85 -17.97 62.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.407 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.607 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -101.85 22.53 12.8 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.594 178.716 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 72' ' ' VAL . . . . . 0.789 HG22 ' O ' ' B' ' 69' ' ' TYR . 4.2 m -118.89 -14.4 9.22 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 O-C-N 121.871 -0.518 . . . . 0.0 112.028 179.514 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 73' ' ' GLU . . . . . 0.475 ' HG3' ' HG ' ' B' ' 74' ' ' LEU . 11.5 pt-20 -75.53 -28.55 59.14 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.702 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -91.88 -41.62 10.51 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 -175.09 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 75' ' ' PHE . . . . . 0.733 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 4.5 m-30 -46.32 -62.73 1.67 Allowed Pre-proline 0 N--CA 1.479 1.015 0 O-C-N 123.533 0.521 . . . . 0.0 111.137 -179.109 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 76' ' ' PRO . . . . . 0.733 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 95.2 Cg_endo -81.43 172.46 12.55 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.445 2.097 . . . . 0.0 111.612 178.671 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.57 -89.48 0.59 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.684 179.464 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 78' ' ' GLY . . . . . 0.716 ' HA3' ' HZ ' ' A' ' 35' ' ' PHE . . . 68.83 60.16 5.5 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.002 -179.953 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.55 -98.69 2.47 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 -178.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.538 -0.744 . . . . 0.0 110.863 179.087 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' C' C ' 81' ' ' GLY . . . . . 0.403 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.821 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 82' ' ' LEU . . . . . 0.58 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 13.1 mt -56.58 -55.01 47.49 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.326 -0.368 . . . . 0.0 111.714 -179.873 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 83' ' ' PRO . . . . . 0.58 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 71.1 Cg_exo -43.31 -42.87 10.44 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.129 2.553 . . . . 0.0 112.657 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -64.82 -36.69 85.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.1 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 85' ' ' VAL . . . . . 0.681 HG22 HG11 ' A' ' 5' ' ' VAL . 47.2 t -66.86 -41.37 87.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.962 179.66 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 86' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.86 -35.93 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.393 0.616 . . . . 0.0 109.678 178.831 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 87' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 44.5 m -70.9 -19.9 62.55 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.057 0.932 . . . . 0.0 108.966 177.265 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 88' ' ' LEU . . . . . 0.54 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 35.9 tp -71.83 -28.56 63.65 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.538 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 89' ' ' ARG . . . . . 0.766 ' HA ' HG13 ' C' ' 92' ' ' VAL . 26.2 mmm-85 -63.09 -22.82 67.12 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.041 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 90' ' ' GLN . . . . . 0.698 ' HG3' ' O ' ' C' ' 87' ' ' SER . 5.1 mt-30 -73.77 -35.25 64.96 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.886 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 91' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 99.0 mm-40 -70.98 -28.7 64.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.976 177.952 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 92' ' ' VAL . . . . . 0.766 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -79.08 -31.49 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 119.982 -0.687 . . . . 0.0 110.359 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -63.37 -34.74 78.37 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 94' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -66.53 -52.43 45.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.244 -1.344 . . . . 0.0 111.256 178.294 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 95' ' ' LEU . . . . . 0.558 HD11 HG13 ' A' ' 12' ' ' VAL . 83.9 mt -56.79 -42.95 80.39 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.788 -1.096 . . . . 0.0 111.464 -179.257 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 96' ' ' GLN . . . . . 0.581 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 13.3 pt20 -74.8 -25.11 58.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.938 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 97' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -68.23 -30.6 73.72 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 177.421 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 98' ' ' GLN . . . . . 0.602 ' HB3' HG11 ' A' ' 19' ' ' VAL . 14.6 mm100 -73.31 -43.12 61.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.934 -0.633 . . . . 0.0 110.495 178.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 99' ' ' VAL . . . . . 0.705 HG21 ' HB3' ' B' ' 58' ' ' GLN . 0.2 OUTLIER -71.52 -34.18 52.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.249 -179.399 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 100' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.5 pt20 -65.32 -43.18 91.8 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.104 177.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 101' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.6 p-80 -78.5 -17.33 56.4 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.563 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 102' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 4.0 mt -74.2 -37.82 63.8 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.367 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 103' ' ' GLN . . . . . 0.648 ' HG2' HD11 ' B' ' 62' ' ' LEU . 33.8 mt-30 -72.46 -31.78 65.71 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.584 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 104' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.28 -53.79 54.16 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.543 177.404 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 105' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' C' ' 109' ' ' TYR . . . -59.32 -46.44 88.57 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.556 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 106' ' ' PHE . . . . . 0.657 ' HE2' ' HG ' ' B' ' 62' ' ' LEU . 0.7 OUTLIER -48.19 -32.94 7.73 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.795 0.684 . . . . 0.0 112.119 179.502 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 38.8 t -53.47 -35.7 60.85 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.913 0.387 . . . . 0.0 111.314 -179.425 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -84.93 -12.95 52.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.894 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 109' ' ' TYR . . . . . 0.797 ' O ' HG22 ' C' ' 112' ' ' VAL . 62.8 m-85 -103.43 -16.18 15.67 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.633 0.73 . . . . 0.0 109.418 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 110' ' ' LYS . . . . . 0.598 ' HA ' ' HE2' ' B' ' 69' ' ' TYR . 82.7 mttt -62.69 -18.46 62.49 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.291 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 111' ' ' LYS . . . . . 0.562 ' HA ' HD11 ' C' ' 114' ' ' LEU . 0.2 OUTLIER -101.65 21.85 13.74 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.313 -0.955 . . . . 0.0 111.868 179.046 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 112' ' ' VAL . . . . . 0.797 HG22 ' O ' ' C' ' 109' ' ' TYR . 4.4 m -118.47 -13.57 10.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 O-C-N 121.893 -0.505 . . . . 0.0 112.285 179.469 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 113' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' C' ' 114' ' ' LEU . 10.6 pt-20 -76.85 -28.83 55.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 114' ' ' LEU . . . . . 0.562 HD11 ' HA ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER -90.84 -41.91 10.93 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.031 -0.986 . . . . 0.0 113.578 -175.492 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' C' C ' 115' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 4.6 m-30 -45.48 -64.48 0.89 Allowed Pre-proline 0 N--CA 1.478 0.942 0 O-C-N 123.387 0.43 . . . . 0.0 111.599 -179.264 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 116' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 98.0 Cg_endo -80.89 171.24 14.49 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.521 2.148 . . . . 0.0 111.521 178.691 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -116.47 -89.88 0.56 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.843 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 118' ' ' GLY . . . . . 0.717 ' HA3' ' HZ ' ' B' ' 75' ' ' PHE . . . 69.58 60.46 5.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.943 -179.82 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 88.94 -97.17 2.29 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 33.0 pt . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.169 178.895 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.518 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 78.5 t . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.59 -23.64 65.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.093 178.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.681 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 52.8 m -72.73 -21.26 61.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.571 0.7 . . . . 0.0 110.475 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.7 tp -76.56 -18.72 58.52 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 5.6 mpt_? -73.8 -40.21 63.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.564 178.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.681 ' HG3' ' O ' ' A' ' 7' ' ' SER . 4.0 pt20 -71.93 -30.35 65.24 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 37.4 tt0 -69.63 -28.62 66.06 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 122.116 0.96 . . . . 0.0 108.479 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 t -74.48 -32.73 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 114.273 -1.33 . . . . 0.0 109.444 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.671 ' HA ' HE21 ' A' ' 16' ' ' GLN . 51.0 mt-10 -71.31 -26.54 62.89 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.32 -41.19 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.477 177.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.3 tp -63.47 -38.42 91.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.385 -1.28 . . . . 0.0 110.107 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.671 HE21 ' HA ' ' A' ' 13' ' ' GLU . 26.2 pt20 -77.0 -21.27 54.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.844 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.897 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -71.36 -33.68 64.28 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.658 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 3.8 mm100 -70.65 -44.6 66.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.472 -0.364 . . . . 0.0 110.474 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.1 p -70.12 -31.69 48.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.734 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.897 HE21 ' HA2' ' A' ' 17' ' ' GLY . 19.2 pt20 -71.91 -38.73 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.4 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.658 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 12.0 p-80 -79.96 -18.0 51.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.197 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.713 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 1.8 mp -79.47 -28.81 41.55 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.531 ' HG2' HD11 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -76.97 -29.11 55.4 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -60.01 -60.92 3.07 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.581 177.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.53 -41.4 94.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.542 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.713 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.04 -28.12 56.1 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.898 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t -60.07 -31.96 70.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.226 0.536 . . . . 0.0 110.77 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -76.82 -48.16 19.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.586 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.628 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 34.5 m-85 -70.89 -15.55 62.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.537 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 37.2 ttmt -66.17 -40.64 90.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.21 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.98 32.41 2.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.738 0.78 . . . . 0.0 110.123 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 6.6 t -94.81 -36.41 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.265 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.414 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 38.5 tt0 -101.89 103.75 14.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 122.493 1.14 . . . . 0.0 110.498 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.428 ' CD2' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.3 -1.553 0 CA-C-N 112.566 -2.106 . . . . 0.0 108.991 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.517 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 70.7 t . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.52 -23.97 65.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.158 178.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.9 m -72.21 -22.09 61.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.436 0.636 . . . . 0.0 110.526 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 23.4 tp -75.82 -18.51 59.45 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 5.4 mpt_? -74.1 -39.38 63.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.516 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.7 pt20 -72.42 -30.77 64.93 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.6 tt0 -69.14 -28.25 66.28 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.105 0.955 . . . . 0.0 108.518 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -75.32 -32.74 26.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 114.44 -1.254 . . . . 0.0 109.453 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.633 ' HA ' HE21 ' B' ' 56' ' ' GLN . 49.0 mt-10 -70.94 -26.39 63.17 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.92 -42.03 73.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.447 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 37.1 tp -63.07 -38.38 90.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.334 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.633 HE21 ' HA ' ' B' ' 53' ' ' GLU . 25.4 pt20 -76.95 -20.77 55.74 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.836 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.886 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -72.13 -33.64 62.02 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 177.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.637 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 3.5 mm100 -70.04 -44.75 68.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.954 0.407 . . . . 0.0 110.357 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.2 p -69.89 -32.12 50.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.891 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.886 HE21 ' HA2' ' B' ' 57' ' ' GLY . 17.6 pt20 -71.89 -38.77 69.93 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.347 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.637 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 11.3 p-80 -79.78 -17.68 52.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.41 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.732 ' O ' ' HB2' ' B' ' 66' ' ' PHE . 1.9 mp -79.93 -29.12 39.67 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.55 ' HG2' HD11 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -75.85 -29.22 58.49 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -59.85 -61.66 2.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.627 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.43 -41.53 89.78 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.66 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.732 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.94 -29.15 59.69 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.108 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.5 t -58.56 -34.06 70.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.004 0.366 . . . . 0.0 110.648 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.431 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 5.1 mm100 -75.21 -47.92 25.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.328 0.585 . . . . 0.0 109.9 178.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.622 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 33.9 m-85 -70.94 -16.13 62.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 37.1 ttmt -66.51 -39.98 88.97 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.443 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.482 ' H ' ' HG3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -98.23 31.39 2.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.684 0.754 . . . . 0.0 109.908 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.622 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -93.82 -36.66 7.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.267 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -102.25 101.86 12.19 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.532 1.158 . . . . 0.0 111.145 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.416 ' N ' ' CD2' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.296 -1.722 0 CA-C-N 112.411 -2.177 . . . . 0.0 108.837 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.559 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 76.3 t . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.55 -24.14 65.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.247 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 56.1 m -72.01 -22.02 61.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.539 0.685 . . . . 0.0 110.207 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.696 ' O ' HG13 ' C' ' 92' ' ' VAL . 25.6 tp -75.69 -19.12 59.34 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.693 ' O ' HG22 ' C' ' 92' ' ' VAL . 4.6 mpt_? -75.94 -36.94 59.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.313 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 4.0 pt20 -73.26 -29.49 62.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.464 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.5 tt0 -69.77 -30.33 67.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 177.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.696 HG13 ' O ' ' C' ' 88' ' ' LEU . 16.0 m -75.85 -27.9 18.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.738 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.675 ' HA ' HE21 ' C' ' 96' ' ' GLN . 52.3 mt-10 -70.26 -28.17 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -70.11 -41.0 74.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.542 177.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 40.2 tp -63.77 -37.52 87.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.27 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.675 HE21 ' HA ' ' C' ' 93' ' ' GLU . 26.2 pt20 -77.69 -21.35 52.16 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.727 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.882 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -71.22 -34.07 64.51 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.661 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 3.1 mm100 -69.84 -44.87 69.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.317 178.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' C' ' 96' ' ' GLN . 10.0 p -70.22 -30.99 45.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.104 -0.639 . . . . 0.0 112.204 -178.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.882 HE21 ' HA2' ' C' ' 97' ' ' GLY . 19.2 pt20 -72.69 -38.86 67.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.001 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.661 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 12.3 p-80 -80.07 -17.16 53.41 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 119.448 -0.901 . . . . 0.0 110.21 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' C' ' 106' ' ' PHE . 1.8 mp -79.79 -29.27 40.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -76.91 -28.83 55.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 176.359 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.84 -61.86 2.3 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.514 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.517 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.12 -41.5 88.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.648 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.647 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.01 -31.44 61.05 Favored 'General case' 0 C--O 1.204 -1.313 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.724 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.4 t -55.74 -34.62 65.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.902 0.382 . . . . 0.0 110.728 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.414 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 4.2 mm100 -75.38 -49.11 20.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.302 0.572 . . . . 0.0 109.967 178.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.616 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 32.7 m-85 -70.36 -16.13 62.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.792 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' C' ' 106' ' ' PHE . 30.1 ttmt -69.32 -34.67 75.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.647 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.469 ' HG3' ' H ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER -101.5 30.66 4.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.452 0.644 . . . . 0.0 109.582 177.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.616 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.2 t -93.47 -37.25 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.337 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 37.2 tt0 -101.45 102.71 13.55 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-O 122.404 1.097 . . . . 0.0 110.559 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.428 ' CD2' ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.63 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.792 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 93.5 t . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.734 0.302 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.67 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.86 -27.34 68.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.511 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 75.2 m -67.7 -28.46 67.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.07 0.462 . . . . 0.0 109.847 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.2 tp -75.48 -21.66 57.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.622 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.719 ' HA ' HG22 ' A' ' 12' ' ' VAL . 39.0 mmm-85 -65.4 -21.53 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' A' ' 7' ' ' SER . 6.6 mt-30 -73.39 -42.83 61.66 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -70.86 -29.29 65.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.782 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.719 HG22 ' HA ' ' A' ' 9' ' ' ARG . 28.3 m -76.42 -40.87 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.634 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.82 -24.13 61.67 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -55.29 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.552 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' B' ' 56' ' ' GLN . 12.3 tp -58.92 -34.12 71.36 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.295 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 15.4 tt0 -67.12 -38.31 85.37 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.484 179.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -61.4 -31.72 78.39 Favored Glycine 0 C--O 1.237 0.324 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.753 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.684 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 95.6 mm-40 -72.94 -49.95 26.37 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.519 HG11 HD22 ' C' ' 95' ' ' LEU . 10.2 p -66.41 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.3 pt20 -68.88 -42.97 76.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.099 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.544 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.8 p-80 -75.81 -17.29 59.9 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.8 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.684 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 12.3 mt -73.57 -37.3 65.56 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 176.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.6 tm0? -70.65 -29.26 65.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.38 -62.13 2.07 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.086 178.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.478 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.18 -41.15 92.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.08 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.609 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -56.04 -28.98 59.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.12 -179.85 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.0 t -61.6 -31.88 71.96 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.028 0.442 . . . . 0.0 110.259 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.452 HE21 ' HA ' ' A' ' 25' ' ' ALA . 52.1 mt-30 -73.97 -52.04 14.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.59 0.71 . . . . 0.0 109.508 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.534 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 56.8 m-85 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.238 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.29 -41.1 98.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.851 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.495 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -96.36 29.67 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.49 0.662 . . . . 0.0 111.272 179.56 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.554 HG21 ' HB2' ' B' ' 73' ' ' GLU . 3.5 t -96.3 -41.12 11.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.594 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.729 ' HB2' HG11 ' C' ' 112' ' ' VAL . 19.3 tt0 -102.74 105.43 15.87 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.63 0.729 . . . . 0.0 109.833 177.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.414 ' CD2' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.615 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.36 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 86.4 t . . . . . 0 N--CA 1.455 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.593 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.644 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.24 -27.62 68.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.443 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.664 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 69.7 m -67.68 -27.89 67.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.011 0.434 . . . . 0.0 109.965 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.46 -21.56 58.0 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.574 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.734 ' HA ' HG22 ' B' ' 52' ' ' VAL . 39.5 mmm-85 -65.38 -21.97 66.74 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.664 ' HG3' ' O ' ' B' ' 47' ' ' SER . 5.8 mt-30 -72.99 -42.09 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.623 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -71.85 -28.48 63.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.51 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' B' ' 49' ' ' ARG . 30.4 m -77.06 -42.25 31.65 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.444 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.95 -25.3 63.57 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.13 -55.2 17.59 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.623 HD11 ' HA ' ' C' ' 96' ' ' GLN . 12.5 tp -59.27 -33.5 71.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.382 -1.281 . . . . 0.0 110.251 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.59 ' HA ' HD11 ' A' ' 15' ' ' LEU . 14.3 tt0 -67.15 -39.2 86.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.521 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.507 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -61.06 -31.72 77.72 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.766 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.701 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 96.0 mm-40 -72.76 -49.5 30.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.02 0.438 . . . . 0.0 111.114 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.445 HG12 ' HA ' ' B' ' 56' ' ' GLN . 9.8 p -66.99 -32.18 56.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 8.0 pt20 -69.96 -42.87 72.6 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.986 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.539 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.8 p-80 -75.74 -17.29 59.96 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.671 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 12.0 mt -73.34 -37.11 66.22 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.495 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.2 tm0? -70.6 -29.98 66.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.39 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.068 178.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.459 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.37 -40.99 88.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.134 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.618 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.2 OUTLIER -56.62 -28.7 61.06 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.225 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.1 t -62.0 -30.68 71.11 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.212 0.53 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.423 HE21 ' HA ' ' B' ' 65' ' ' ALA . 54.8 mt-30 -75.07 -51.21 14.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.584 0.706 . . . . 0.0 109.389 178.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 61.0 m-85 -66.28 -16.42 64.01 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.299 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.67 -41.79 98.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.879 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.505 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -95.83 29.42 2.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.362 0.601 . . . . 0.0 111.543 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' C' ' 113' ' ' GLU . 3.6 t -96.28 -40.24 10.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.457 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.554 ' HB2' HG21 ' A' ' 32' ' ' VAL . 19.1 tt0 -103.68 105.36 15.56 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 122.011 0.91 . . . . 0.0 109.922 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.407 ' N ' ' CD2' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.658 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.316 -179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.456 -0.163 0 CA-C-O 120.572 0.225 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.686 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.42 -26.97 68.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.394 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 75.5 m -68.07 -28.32 67.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 0.0 109.956 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.36 -21.54 58.26 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.333 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.686 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 42.6 mmm-85 -63.92 -23.65 67.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.694 178.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' C' ' 87' ' ' SER . 5.8 mt-30 -72.48 -44.55 62.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.169 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -69.26 -27.46 65.45 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.788 0.804 . . . . 0.0 110.795 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.27 -45.11 35.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.525 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.4 -21.8 61.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -55.47 13.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.375 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.519 HD22 HG11 ' A' ' 19' ' ' VAL . 1.4 mt -56.46 -38.18 71.31 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.118 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.623 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.0 tt0 -64.23 -38.98 92.97 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.163 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.503 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.88 -31.65 79.12 Favored Glycine 0 C--O 1.238 0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.587 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.697 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 96.2 mm-40 -73.04 -50.04 25.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 111.189 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.492 HG12 ' HA ' ' C' ' 96' ' ' GLN . 9.6 p -66.37 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 8.0 pt20 -68.94 -43.41 75.12 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.026 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.553 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 6.6 p-80 -75.53 -17.06 60.19 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.967 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 12.8 mt -74.25 -36.62 63.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.534 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.1 tm0? -70.94 -29.18 65.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.19 -63.07 1.39 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.829 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.465 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.39 -42.01 90.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.136 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.635 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.2 OUTLIER -55.57 -29.1 58.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.174 -0.921 . . . . 0.0 112.308 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 10.6 t -61.98 -30.62 71.06 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.028 0.442 . . . . 0.0 110.653 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.415 HE21 ' HA ' ' C' ' 105' ' ' ALA . 53.1 mt-30 -75.56 -51.1 13.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.594 0.712 . . . . 0.0 109.401 178.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.634 ' HA ' HG13 ' C' ' 112' ' ' VAL . 58.7 m-85 -66.03 -17.38 64.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.016 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -60.76 -39.49 88.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.08 -0.963 . . . . 0.0 110.907 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.501 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.56 26.64 4.83 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.729 HG11 ' HB2' ' A' ' 33' ' ' GLU . 1.1 m -99.41 -30.58 3.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.816 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.542 ' HB2' HG21 ' B' ' 72' ' ' VAL . 18.4 tt0 -102.95 103.22 13.33 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 121.922 0.868 . . . . 0.0 109.566 176.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.408 ' CD2' ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.3 -1.573 0 CA-C-N 113.399 -1.728 . . . . 0.0 110.329 -179.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.563 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 85.2 t . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.681 0.277 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.28 -33.47 69.79 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.708 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -69.45 -20.25 63.76 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.416 1.103 . . . . 0.0 108.294 177.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 28.6 tp -76.3 -29.65 57.43 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.323 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.606 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 22.6 mmm-85 -66.37 -39.94 89.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.074 0.464 . . . . 0.0 109.997 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.708 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -69.76 -41.93 74.54 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.14 179.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 7.4 tt0 -66.62 -34.94 79.0 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.104 0.478 . . . . 0.0 111.377 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 9' ' ' ARG . 5.7 p -76.97 -30.88 18.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -69.98 -30.56 67.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.47 -56.29 13.22 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.716 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.2 tp -58.39 -34.52 70.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.054 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.458 ' HA ' HD11 ' C' ' 95' ' ' LEU . 19.7 tt0 -65.27 -44.29 88.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.688 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.526 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -61.13 -31.31 76.33 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.625 179.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 69.8 mt-30 -71.95 -43.71 64.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.898 0.38 . . . . 0.0 110.584 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.2 t -67.52 -40.93 85.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.839 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.8 pt20 -61.98 -42.12 98.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.059 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.3 p-80 -79.78 -17.16 54.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.771 -0.772 . . . . 0.0 111.024 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 11.5 mt -71.64 -41.19 69.1 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -70.82 -31.97 68.88 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.66 -55.43 34.98 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.755 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.673 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.89 -39.94 93.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.693 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.416 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -55.05 -29.67 57.97 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.381 179.43 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -49.83 -26.87 4.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.029 0.442 . . . . 0.0 111.122 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.451 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 4.9 mm100 -96.66 -42.82 7.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.921 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.1 m-85 -73.58 -20.4 60.63 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -178.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 51.5 mtmt -70.38 -26.95 63.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.78 0.324 . . . . 0.0 110.64 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.64 31.6 5.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.74 0.781 . . . . 0.0 109.738 178.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.631 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 2.9 t -93.38 -42.12 12.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.238 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -97.71 100.05 11.43 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 122.336 1.065 . . . . 0.0 110.687 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.69 0 CA-C-N 112.742 -2.026 . . . . 0.0 109.615 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.535 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 99.9 t . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.77 0.319 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -71.2 -33.74 70.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 48.3 m -69.51 -20.6 63.71 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 122.373 1.082 . . . . 0.0 108.611 176.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.535 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 28.7 tp -75.95 -30.04 58.52 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.033 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 22.6 mmm-85 -66.21 -39.12 89.39 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.158 0.504 . . . . 0.0 110.319 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -70.24 -42.65 71.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.016 179.851 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 7.5 tt0 -65.55 -35.58 81.26 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.455 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.502 HG12 ' O ' ' B' ' 49' ' ' ARG . 5.4 p -76.52 -30.24 19.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.757 -178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.86 -29.88 66.11 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -66.43 -56.3 11.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.454 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' C' ' 96' ' ' GLN . 27.3 tp -58.0 -34.47 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.039 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.442 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.4 tt0 -65.21 -45.09 86.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.571 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -60.07 -31.91 74.24 Favored Glycine 0 C--O 1.236 0.26 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.605 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.8 mt-30 -71.3 -44.01 65.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 110.681 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.0 t -67.35 -40.18 84.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.7 pt20 -63.2 -41.95 99.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.339 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.476 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.99 -18.11 54.23 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.676 -0.809 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 11.4 mt -71.14 -40.33 71.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.647 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -71.8 -31.77 66.91 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.7 -55.41 35.19 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.847 177.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.686 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.88 -40.91 97.02 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.636 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -54.73 -29.12 52.66 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.573 179.306 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.8 t -50.35 -27.76 6.81 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 111.109 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 4.3 mm100 -95.41 -42.47 8.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.893 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.686 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 15.2 m-85 -74.06 -19.49 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 51.7 mtmt -71.11 -26.62 63.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.612 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -106.69 31.57 5.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.682 0.753 . . . . 0.0 109.666 178.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 3.0 t -93.44 -42.51 13.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.991 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 38.3 tt0 -96.86 100.7 12.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.229 1.014 . . . . 0.0 110.846 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.7 0 CA-C-N 112.653 -2.067 . . . . 0.0 109.795 179.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.588 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 96.0 t . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.25 -34.52 70.83 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.723 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.2 m -69.23 -20.79 63.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.264 1.031 . . . . 0.0 108.312 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.789 ' O ' HG22 ' C' ' 92' ' ' VAL . 30.2 tp -74.64 -31.7 62.05 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.991 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.588 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 23.5 mmm-85 -64.87 -40.15 94.69 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.663 0.602 . . . . 0.0 110.524 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.723 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.83 -42.0 82.14 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 7.8 tt0 -64.76 -37.05 86.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.077 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.789 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -70.79 -38.82 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.603 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.35 -31.13 71.72 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -67.1 -57.54 6.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.792 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.493 ' O ' HG23 ' C' ' 99' ' ' VAL . 26.7 tp -57.83 -34.69 69.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.297 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.493 ' HA ' HD11 ' B' ' 55' ' ' LEU . 21.7 tt0 -65.23 -44.83 86.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.489 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.425 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.21 -31.55 73.73 Favored Glycine 0 C--O 1.238 0.388 0 N-CA-C 111.629 -0.588 . . . . 0.0 111.629 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 71.9 mt-30 -72.52 -43.65 63.27 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.643 -0.328 . . . . 0.0 110.532 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.493 HG23 ' O ' ' C' ' 95' ' ' LEU . 59.6 t -67.63 -40.11 83.49 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.425 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 3.7 pt20 -62.87 -42.37 99.74 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.313 -0.155 . . . . 0.0 111.12 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.51 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 6.6 p-80 -79.24 -17.32 54.99 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.966 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 11.0 mt -71.51 -40.73 69.96 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 177.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.19 -32.27 68.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.54 -54.95 41.01 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.936 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.692 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.28 -40.34 95.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.554 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.52 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -54.89 -29.32 55.47 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.473 179.028 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.8 t -49.64 -27.19 4.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.91 0.386 . . . . 0.0 111.298 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.432 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 4.4 mm100 -96.16 -43.31 7.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.924 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.692 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 14.4 m-85 -73.38 -20.36 60.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.52 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 49.8 mtmt -70.74 -25.8 63.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.675 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.475 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -108.48 32.8 4.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.823 0.82 . . . . 0.0 109.516 178.147 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 3.0 t -93.79 -42.87 13.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.861 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.536 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 32.3 tt0 -96.73 99.55 11.14 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.35 1.072 . . . . 0.0 111.149 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.536 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.767 0 CA-C-N 112.523 -2.126 . . . . 0.0 109.397 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 84.0 t . . . . . 0 N--CA 1.452 -0.333 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.778 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.88 -27.97 62.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.606 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 57.1 p -72.64 -19.63 61.41 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.481 HD11 HG11 ' B' ' 52' ' ' VAL . 57.9 tp -78.96 -24.13 44.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.354 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.778 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -65.82 -47.69 74.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.6 OUTLIER -65.37 -42.19 92.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.95 179.54 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -62.04 -34.32 76.02 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.374 0.607 . . . . 0.0 110.141 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.492 HG11 HD11 ' C' ' 88' ' ' LEU . 1.2 t -77.46 -31.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.299 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 51.5 mt-10 -66.88 -30.41 70.57 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -53.1 27.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.316 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 74.7 mt -58.8 -34.21 71.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.151 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.63 -46.86 74.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.502 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.512 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.06 -31.9 74.2 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.54 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.0 mt-30 -71.3 -46.88 59.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.839 0.352 . . . . 0.0 110.745 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' LEU . 89.5 t -64.46 -42.36 95.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.4 pt20 -62.36 -42.71 99.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.391 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.422 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 4.6 p-80 -78.01 -16.65 57.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.966 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.2 mt -72.0 -41.96 66.99 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.615 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -66.4 -36.12 82.04 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.46 -54.9 40.31 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.887 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.05 -41.86 93.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.367 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 4.3 m-85 -53.7 -32.17 50.85 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.646 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.9 t -49.71 -30.53 9.44 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.446 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 13.3 mm100 -91.62 -42.24 10.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.603 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.6 m-85 -73.33 -20.42 60.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.968 0.413 . . . . 0.0 111.37 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.534 ' HD2' ' O ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -63.23 -32.85 74.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.265 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -104.14 23.91 12.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.396 0.617 . . . . 0.0 110.548 178.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -93.74 -23.34 5.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.589 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' H ' ' A' ' 34' ' ' LEU . 72.8 tt0 -81.22 -126.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 31' ' ' LYS . 3.0 mt . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.447 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 86.8 t . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.802 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.88 -27.1 61.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.882 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.68 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 49.6 p -73.92 -19.18 60.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.515 HD11 HG11 ' C' ' 92' ' ' VAL . 56.3 tp -78.89 -22.93 45.21 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.239 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.802 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -67.07 -47.66 70.61 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.7 OUTLIER -64.88 -43.07 94.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.774 179.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.23 -34.42 75.09 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.609 0.719 . . . . 0.0 110.395 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.481 HG11 HD11 ' A' ' 8' ' ' LEU . 1.1 t -78.08 -30.42 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.366 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 51.6 mt-10 -68.06 -29.52 68.51 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.08 21.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.9 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.495 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -58.56 -34.03 70.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.194 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -67.02 -46.89 73.1 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.655 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.537 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.89 -32.05 73.86 Favored Glycine 0 C--O 1.236 0.269 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.478 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 74.5 mt-30 -70.96 -47.55 58.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.764 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 55' ' ' LEU . 94.9 t -64.11 -41.85 93.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.5 pt20 -62.51 -43.31 99.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.412 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -77.31 -16.67 58.84 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.1 mt -72.01 -41.97 66.94 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.651 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.38 -36.48 82.96 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.17 -55.42 33.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.665 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.734 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.25 -42.07 90.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.51 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 4.3 m-85 -53.86 -32.7 53.99 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.658 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 47.7 t -48.17 -32.91 7.64 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.068 0.461 . . . . 0.0 111.054 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.448 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 12.8 mm100 -89.63 -41.86 11.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.871 0.367 . . . . 0.0 111.894 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.734 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 41.0 m-85 -72.76 -21.8 60.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.548 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.492 ' HD2' ' O ' ' B' ' 70' ' ' LYS . 0.4 OUTLIER -62.36 -33.63 75.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.187 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.571 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -103.47 23.61 12.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.465 0.65 . . . . 0.0 110.544 178.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -93.27 -23.29 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.485 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' B' ' 74' ' ' LEU . 71.9 tt0 -81.28 -127.01 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.571 HD11 ' HA ' ' B' ' 71' ' ' LYS . 2.7 mt . . . . . 0 N--CA 1.474 0.728 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.458 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 86.4 t . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.818 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -73.1 -27.34 61.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.855 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 53.8 p -73.13 -19.26 61.17 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 12' ' ' VAL . 55.8 tp -79.19 -23.22 43.99 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.468 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.818 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.6 OUTLIER -66.67 -47.67 71.74 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.6 OUTLIER -65.23 -42.9 92.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.85 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -61.2 -34.94 75.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.5 0.667 . . . . 0.0 110.249 179.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.515 HG11 HD11 ' B' ' 48' ' ' LEU . 1.1 t -77.14 -30.88 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.389 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 53.0 mt-10 -68.1 -30.54 69.74 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.39 -53.1 32.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.172 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.509 ' O ' HG23 ' C' ' 99' ' ' VAL . 70.9 mt -59.02 -34.04 71.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.214 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -67.02 -46.68 73.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.691 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.517 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -60.08 -32.12 74.94 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.732 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 74.6 mt-30 -70.78 -47.58 58.8 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 120.886 0.374 . . . . 0.0 110.775 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.509 HG23 ' O ' ' C' ' 95' ' ' LEU . 87.8 t -64.01 -41.68 93.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 2.5 pt20 -63.16 -42.38 99.41 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.415 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 5.1 p-80 -78.14 -16.99 57.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.809 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 10.5 mt -71.35 -41.51 69.67 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.634 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -66.65 -36.8 83.43 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -55.68 -54.7 41.01 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.665 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.61 -42.07 96.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.393 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 4.4 m-85 -53.73 -31.75 49.48 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.655 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.5 t -49.77 -32.19 13.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.419 ' O ' ' HE3' ' C' ' 111' ' ' LYS . 13.1 mm100 -89.47 -43.16 11.04 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.642 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 38.0 m-85 -72.7 -20.76 61.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 111.409 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HD2' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -62.48 -29.54 70.61 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -106.22 19.88 19.83 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.074 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.679 HG22 ' O ' ' C' ' 109' ' ' TYR . 34.7 m -92.17 -19.14 7.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.312 177.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -76.46 -124.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.338 0.098 0 CA-C-O 121.765 0.793 . . . . 0.0 112.6 177.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 60.3 t . . . . . 0 CA--C 1.53 0.19 0 CA-C-O 120.77 0.319 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.72 -26.67 62.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.967 0.413 . . . . 0.0 110.551 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 65.1 m -70.89 -19.29 62.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.851 0.834 . . . . 0.0 108.995 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.437 HD11 HG11 ' B' ' 52' ' ' VAL . 67.6 tp -76.64 -23.69 53.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.781 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 1.6 mmt85 -67.98 -32.63 73.18 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -70.87 -47.82 57.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.734 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.518 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 39.5 tt0 -63.25 -32.36 73.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.838 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.633 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.1 p -77.02 -32.52 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.109 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 44.0 mt-10 -70.78 -27.36 63.86 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.81 -53.69 20.17 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.48 -1.237 . . . . 0.0 109.288 178.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 77.0 mt -57.62 -33.33 68.13 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.384 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.457 ' HA ' HG12 ' A' ' 19' ' ' VAL . 17.8 tt0 -69.75 -44.35 70.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.8 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -60.99 -31.52 76.78 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.612 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -73.77 -46.83 43.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 16' ' ' GLN . 13.4 p -69.86 -31.09 46.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.749 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -71.42 -40.47 70.42 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.171 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.1 p-80 -79.77 -18.65 50.53 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.888 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.5 mt -73.37 -39.45 65.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.746 ' HG3' HD11 ' C' ' 102' ' ' LEU . 37.5 tt0 -65.99 -41.36 91.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.326 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.67 -46.79 74.1 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.263 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.713 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.81 -38.13 89.95 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.876 -1.057 . . . . 0.0 110.437 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.758 ' HB3' ' HG3' ' A' ' 30' ' ' LYS . 3.8 m-85 -59.24 -20.52 54.82 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.7 t -55.31 -23.68 24.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.099 0.476 . . . . 0.0 110.589 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.507 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 4.8 mm100 -107.83 -20.85 13.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.015 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.713 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 27.8 m-85 -96.08 -17.25 21.05 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.758 ' HG3' ' HB3' ' A' ' 26' ' ' PHE . 73.6 mttt -68.42 -29.83 68.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.829 0.347 . . . . 0.0 110.351 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HD3' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -102.32 26.71 7.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.057 0.456 . . . . 0.0 110.303 178.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.664 HG23 ' HA ' ' A' ' 29' ' ' TYR . 5.1 t -87.37 -42.87 15.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.464 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 10.6 tt0 -99.86 105.35 17.09 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.224 1.012 . . . . 0.0 111.075 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.439 ' CD2' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.471 0 CA-C-N 112.718 -2.037 . . . . 0.0 110.618 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.426 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 57.4 t . . . . . 0 CA--C 1.529 0.166 0 CA-C-O 120.661 0.267 . . . . 0.0 110.992 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.21 -26.11 61.91 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.53 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.6 m -71.09 -18.94 62.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.873 0.844 . . . . 0.0 108.982 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.431 HD11 HG11 ' C' ' 92' ' ' VAL . 69.8 tp -76.98 -23.76 52.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.877 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 1.7 mmt85 -67.99 -32.57 73.06 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.517 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.1 OUTLIER -70.84 -49.11 49.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.747 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' B' ' 55' ' ' LEU . 39.7 tt0 -62.42 -31.69 72.43 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -77.56 -32.35 18.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.265 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 44.1 mt-10 -70.9 -27.67 63.96 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.35 -53.98 20.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.258 178.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 78.5 mt -57.87 -32.6 67.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.372 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.432 ' HA ' HG12 ' B' ' 59' ' ' VAL . 16.7 tt0 -70.41 -44.83 67.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.688 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.0 -31.12 75.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.476 179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.5 OUTLIER -73.72 -46.56 45.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.729 0.3 . . . . 0.0 111.489 179.37 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' B' ' 56' ' ' GLN . 13.2 p -70.21 -30.94 45.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.641 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 19.1 pt20 -71.42 -40.86 70.18 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.828 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.531 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.0 p-80 -79.34 -19.11 51.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.656 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.9 mt -73.25 -39.72 65.2 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.564 ' HG3' HD21 ' A' ' 22' ' ' LEU . 37.7 tt0 -65.35 -42.18 93.1 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.1 -46.75 72.17 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.46 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.727 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.393 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.752 ' HB3' ' HG3' ' B' ' 70' ' ' LYS . 3.6 m-85 -58.49 -20.91 49.52 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 39.9 t -54.12 -25.61 23.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.054 0.454 . . . . 0.0 110.495 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.542 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 4.5 mm100 -106.51 -20.91 13.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.2 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.727 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 26.7 m-85 -95.75 -17.56 21.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' B' ' 66' ' ' PHE . 73.4 mttt -68.27 -30.24 69.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.076 0.465 . . . . 0.0 110.632 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.488 ' HB2' ' HE3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -101.88 26.61 7.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.298 0.571 . . . . 0.0 110.465 178.426 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.633 HG23 ' HA ' ' B' ' 69' ' ' TYR . 5.0 t -87.63 -42.44 15.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.645 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.507 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 12.4 tt0 -100.62 103.66 14.96 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 122.13 0.967 . . . . 0.0 111.339 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.444 ' N ' ' CD2' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.499 0 CA-C-N 112.68 -2.055 . . . . 0.0 110.822 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.42 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 64.8 t . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.798 0.332 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.51 -26.05 62.51 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.001 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.526 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 67.2 m -71.82 -18.5 62.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.893 0.854 . . . . 0.0 108.849 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.467 HD11 HG11 ' A' ' 12' ' ' VAL . 65.6 tp -77.08 -23.25 51.93 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.634 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.645 ' O ' HG12 ' C' ' 92' ' ' VAL . 1.9 mmt85 -67.99 -32.51 72.96 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -71.29 -48.14 52.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.026 179.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.541 ' O ' ' HG ' ' C' ' 95' ' ' LEU . 38.7 tt0 -63.3 -31.77 73.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.583 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.645 HG12 ' O ' ' C' ' 89' ' ' ARG . 1.1 p -77.29 -32.7 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.263 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 43.9 mt-10 -70.95 -26.26 63.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.79 18.14 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.173 178.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' C' ' 91' ' ' GLN . 75.5 mt -57.91 -32.77 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.423 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.439 ' O ' ' HG2' ' C' ' 100' ' ' GLN . 16.9 tt0 -69.68 -44.84 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.623 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.472 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.61 -31.3 74.51 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.748 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.623 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 0.5 OUTLIER -74.72 -44.94 47.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.692 0.282 . . . . 0.0 111.509 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' C' ' 96' ' ' GLN . 13.5 p -71.34 -30.51 40.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.453 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.472 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.2 pt20 -71.64 -42.2 67.89 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.157 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.623 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 10.5 p-80 -77.48 -19.03 56.54 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.902 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.746 HD11 ' HG3' ' A' ' 23' ' ' GLN . 1.5 mp -73.89 -39.45 63.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.532 ' HG3' HD21 ' B' ' 62' ' ' LEU . 38.2 tt0 -66.62 -41.46 88.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.03 71.72 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.421 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.739 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.33 -39.07 93.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.455 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.756 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 3.5 m-85 -58.58 -20.28 45.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.4 t -54.6 -25.67 27.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.212 0.529 . . . . 0.0 110.245 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' C' ' 111' ' ' LYS . 4.7 mm100 -105.54 -22.82 12.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.085 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.739 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 25.8 m-85 -93.75 -17.83 22.73 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.756 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 74.2 mttt -68.01 -28.54 67.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.021 0.439 . . . . 0.0 110.619 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.05 26.52 8.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.223 0.535 . . . . 0.0 110.327 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' C' ' 109' ' ' TYR . 4.6 t -87.09 -42.66 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.214 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.542 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 7.4 tt0 -99.95 104.77 16.42 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 122.043 0.925 . . . . 0.0 111.342 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.42 ' CD2' ' N ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.465 0 CA-C-N 112.964 -1.926 . . . . 0.0 111.034 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.701 HG22 HG11 ' B' ' 45' ' ' VAL . 82.7 t . . . . . 0 N--CA 1.455 -0.197 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -66.68 -37.52 84.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.785 0.326 . . . . 0.0 110.521 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.716 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 41.1 m -63.32 -26.35 68.72 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.834 0.826 . . . . 0.0 109.154 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 12' ' ' VAL . 62.5 tp -74.21 -39.87 62.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.255 178.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -55.86 -44.4 78.03 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.716 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -63.8 -42.15 97.76 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.757 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.7 tt0 -63.22 -34.8 78.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.989 0.423 . . . . 0.0 110.738 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 8' ' ' LEU . 54.5 t -70.07 -40.63 78.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.577 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 32.5 tt0 -63.3 -32.02 73.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.49 -61.42 2.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.549 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.7 mm? -60.27 -31.41 70.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.485 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.547 ' HA ' HG12 ' A' ' 19' ' ' VAL . 14.4 pt20 -74.16 -28.61 61.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -67.0 -33.55 84.16 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.72 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.9 mm100 -71.09 -50.5 33.1 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.334 -0.433 . . . . 0.0 111.102 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.547 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.4 p -66.8 -33.52 63.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.362 -0.535 . . . . 0.0 111.995 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.58 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -66.11 -43.17 87.99 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.96 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -76.97 -19.71 56.99 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.208 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.771 HD21 ' HG2' ' B' ' 63' ' ' GLN . 24.6 mt -71.01 -42.72 69.22 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' C' ' 102' ' ' LEU . 5.8 tm0? -70.19 -33.49 71.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.89 -62.46 1.73 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.48 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.709 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.85 -42.61 98.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.863 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.74 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -57.0 -25.98 59.45 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.705 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -53.75 -28.59 35.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.267 0.556 . . . . 0.0 110.207 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 14.1 mt-30 -90.75 -50.29 5.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.893 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.709 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 19.5 m-85 -66.58 -17.81 65.02 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -70.86 -20.71 62.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 110.782 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.56 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.25 35.52 3.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.592 0.71 . . . . 0.0 109.495 178.333 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 29' ' ' TYR . 15.5 t -98.65 -35.64 5.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.805 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.549 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 40.3 tt0 -88.19 89.76 8.12 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 122.861 1.315 . . . . 0.0 110.934 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.56 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.995 0 CA-C-N 111.983 -2.371 . . . . 0.0 109.068 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.701 HG11 HG22 ' A' ' 5' ' ' VAL . 83.7 t . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.678 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.34 -38.38 87.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.667 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.0 m -63.8 -23.91 67.55 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.803 0.811 . . . . 0.0 109.548 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.795 ' O ' HG23 ' B' ' 52' ' ' VAL . 65.0 tp -76.04 -39.35 55.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.678 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -56.01 -44.2 78.45 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -64.21 -42.88 96.41 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.565 179.575 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.0 tt0 -62.04 -35.08 77.53 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.034 0.445 . . . . 0.0 110.787 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.795 HG23 ' O ' ' B' ' 48' ' ' LEU . 57.9 t -70.44 -40.11 77.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.607 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 32.9 tt0 -63.39 -32.05 73.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.8 0.809 . . . . 0.0 109.006 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.53 -61.19 2.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.588 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' B' ' 55' ' ' LEU . 2.6 mm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.353 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.532 ' HA ' HG12 ' B' ' 59' ' ' VAL . 14.1 pt20 -73.94 -28.78 61.68 Favored 'General case' 0 C--O 1.222 -0.395 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.577 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -67.25 -33.25 82.14 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 119.909 -1.138 . . . . 0.0 110.506 178.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.723 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.8 mm-40 -71.42 -49.66 39.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.547 -0.326 . . . . 0.0 111.263 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.8 p -67.56 -33.06 59.85 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.959 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -66.06 -44.36 84.78 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.899 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -76.01 -19.93 58.25 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.408 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 23.0 mt -71.28 -42.31 68.9 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.771 ' HG2' HD21 ' A' ' 22' ' ' LEU . 5.8 tm0? -69.98 -34.67 73.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.3 -61.94 2.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.459 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.68 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.16 -42.78 99.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.666 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.745 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.67 -26.15 55.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.195 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.9 t -54.1 -27.9 35.89 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.272 0.558 . . . . 0.0 110.325 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 14.3 mt-30 -90.87 -51.0 5.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.592 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.68 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 17.4 m-85 -65.72 -17.83 64.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -71.41 -20.64 62.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.979 0.419 . . . . 0.0 110.756 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.556 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -107.17 36.07 2.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.135 0.969 . . . . 0.0 109.181 178.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.495 HG23 ' HA ' ' B' ' 69' ' ' TYR . 15.6 t -99.56 -35.01 4.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.72 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 46.5 tt0 -88.85 89.12 7.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 122.869 1.319 . . . . 0.0 111.029 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.556 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.958 0 CA-C-N 111.713 -2.494 . . . . 0.0 109.256 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.668 HG22 HG11 ' A' ' 5' ' ' VAL . 89.5 t . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.609 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -66.81 -38.35 86.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.401 . . . . 0.0 110.166 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 20.9 m -62.78 -26.31 68.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.883 0.849 . . . . 0.0 109.287 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.691 ' O ' HG12 ' C' ' 92' ' ' VAL . 63.5 tp -73.09 -42.1 63.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.004 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.675 ' HB3' HH11 ' C' ' 89' ' ' ARG . 0.0 OUTLIER -55.82 -43.82 77.31 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.952 0.342 . . . . 0.0 110.637 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -63.48 -41.74 98.57 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.031 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -63.0 -36.77 84.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.953 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.691 HG12 ' O ' ' C' ' 88' ' ' LEU . 0.2 OUTLIER -74.8 -31.29 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.398 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.581 -179.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.535 ' O ' ' HG2' ' C' ' 96' ' ' GLN . 36.7 tt0 -65.34 -33.49 76.09 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.51 -58.85 4.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.657 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.3 mm? -60.97 -31.08 70.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.07 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' C' ' 99' ' ' VAL . 14.5 pt20 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.588 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -66.63 -34.11 86.51 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.157 -1.02 . . . . 0.0 110.619 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.5 mm-40 -70.62 -49.43 47.65 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.367 -0.416 . . . . 0.0 111.089 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.7 p -68.08 -32.74 57.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 C-N-CA 120.342 -0.543 . . . . 0.0 112.194 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.86 -43.21 84.2 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.681 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -76.87 -19.69 57.17 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.013 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 23.6 mt -71.55 -41.95 68.45 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.7 ' HG2' HD21 ' B' ' 62' ' ' LEU . 6.3 tm0? -70.69 -34.21 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.39 -62.4 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.472 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.46 -42.49 96.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.664 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.705 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -56.27 -28.26 58.02 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.705 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.8 t -51.19 -29.93 15.49 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.133 0.492 . . . . 0.0 110.314 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.549 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 13.6 mt-30 -89.82 -51.33 5.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.047 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 19.3 m-85 -66.34 -17.27 64.67 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -177.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.47 -19.37 62.22 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.984 0.421 . . . . 0.0 110.875 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.491 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -109.08 35.7 3.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.812 0.815 . . . . 0.0 109.29 177.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.523 HG23 ' HA ' ' C' ' 109' ' ' TYR . 16.2 t -98.28 -36.08 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.835 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 43.1 tt0 -87.32 89.51 8.02 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.958 1.361 . . . . 0.0 111.039 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.491 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.292 -1.933 0 CA-C-N 112.071 -2.331 . . . . 0.0 109.202 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.483 HG22 HG11 ' B' ' 45' ' ' VAL . 96.7 t . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.688 0.28 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.81 -33.46 75.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.112 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.4 m -66.95 -28.71 68.51 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.645 0.735 . . . . 0.0 109.792 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 70.0 tp -73.28 -22.34 60.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.09 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 12' ' ' VAL . 25.8 mmm-85 -69.13 -23.59 63.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.3 OUTLIER -75.34 -40.2 58.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -72.07 -29.29 63.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.841 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.727 HG22 ' HA ' ' A' ' 9' ' ' ARG . 27.6 m -76.05 -38.71 35.6 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.296 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 95.7 mt-10 -70.06 -28.84 65.77 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.65 -60.85 2.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.015 177.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.0 mm? -58.3 -39.43 79.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 17.0 pt20 -67.13 -28.1 67.86 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.738 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.664 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -66.66 -33.42 84.36 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.74 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 82.3 mt-30 -72.05 -40.42 68.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.718 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' LEU . 2.6 t -67.65 -39.9 83.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.963 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.664 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.2 pt20 -62.18 -42.18 99.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.926 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.437 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 5.9 p-80 -81.66 -16.79 50.24 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.44 -0.904 . . . . 0.0 111.56 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.74 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -74.01 -43.6 57.43 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.576 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.7 tm0? -68.07 -36.22 79.49 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.64 70.88 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.159 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.33 -43.91 95.99 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.581 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.649 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 1.8 m-85 -52.28 -30.17 26.68 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.489 0.493 . . . . 0.0 111.953 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.5 t -50.69 -31.92 17.81 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.984 0.421 . . . . 0.0 111.142 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.442 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 97.1 mm-40 -89.57 -44.62 9.96 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.8 m-85 -65.21 -20.02 66.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.867 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.3 -26.11 60.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.526 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.23 32.39 4.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.012 0.91 . . . . 0.0 109.453 178.013 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.735 HG11 HG12 ' B' ' 72' ' ' VAL . 65.7 t -128.13 -24.48 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.55 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.855 ' HG3' ' H ' ' A' ' 34' ' ' LEU . 3.5 pt-20 -65.18 -63.8 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.718 0.77 . . . . 0.0 112.361 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.855 ' H ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.869 0 CA-C-N 113.53 -1.668 . . . . 0.0 115.107 -177.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.483 HG11 HG22 ' A' ' 5' ' ' VAL . 96.4 t . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.773 0.321 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.521 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.1 -33.71 76.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.327 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.9 m -67.17 -28.07 67.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.688 0.756 . . . . 0.0 109.594 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 tp -73.15 -23.03 60.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.101 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.737 ' HA ' HG22 ' B' ' 52' ' ' VAL . 24.1 mmm-85 -69.07 -23.16 64.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.5 OUTLIER -74.99 -40.53 60.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.596 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -72.01 -29.12 63.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.872 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.737 HG22 ' HA ' ' B' ' 49' ' ' ARG . 27.2 m -76.4 -38.59 32.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.206 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 92.6 mt-10 -70.34 -28.06 64.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.79 -60.72 2.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.196 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.584 HD12 HG11 ' C' ' 99' ' ' VAL . 2.1 mm? -58.26 -39.59 79.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.005 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.7 pt20 -66.92 -28.45 68.31 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.398 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -66.15 -33.65 85.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.713 178.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 82.4 mt-30 -71.78 -40.37 69.3 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.497 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' O ' ' B' ' 55' ' ' LEU . 2.5 t -67.99 -39.84 82.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.064 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.3 pt20 -61.53 -42.48 98.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.83 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 5.9 p-80 -81.51 -17.77 47.42 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.447 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 6.5 mt -72.73 -43.7 62.64 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -68.36 -36.54 79.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.99 -50.63 70.31 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.589 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.737 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.36 -43.83 96.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.394 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.598 ' HA ' ' HD2' ' B' ' 69' ' ' TYR . 1.5 m-85 -51.48 -30.67 20.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.692 0.62 . . . . 0.0 111.854 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 40.6 t -49.82 -33.47 16.81 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.837 0.351 . . . . 0.0 111.106 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' B' ' 71' ' ' LYS . 97.4 mm-40 -88.68 -44.4 10.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.492 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.737 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 46.1 m-85 -64.86 -20.5 66.45 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.771 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -57.47 -27.21 62.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.234 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -105.01 31.97 4.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.083 0.944 . . . . 0.0 109.351 178.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.735 HG12 HG11 ' A' ' 32' ' ' VAL . 64.6 t -127.83 -24.8 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.257 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.871 ' HG3' ' H ' ' B' ' 74' ' ' LEU . 3.4 pt-20 -64.44 -64.53 0.86 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.663 0.744 . . . . 0.0 112.191 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.871 ' H ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.812 0 C-N-CA 125.987 1.715 . . . . 0.0 115.271 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.453 HG11 HG22 ' B' ' 45' ' ' VAL . 85.2 t . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.646 0.26 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.76 -33.05 75.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.73 0.3 . . . . 0.0 111.129 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.7 m -66.86 -29.05 68.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.652 0.739 . . . . 0.0 109.489 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.438 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 70.2 tp -72.7 -22.77 60.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.86 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 31.2 mmm-85 -66.32 -27.46 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.3 OUTLIER -73.02 -42.16 63.48 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.905 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.83 -27.37 63.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.662 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 0.8 OUTLIER -76.16 -42.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.314 -178.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.578 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 94.2 mt-10 -70.97 -27.16 63.53 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.76 -61.08 2.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.257 -1.338 . . . . 0.0 110.079 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.557 ' O ' HG12 ' C' ' 99' ' ' VAL . 1.6 mm? -58.09 -37.97 75.52 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.95 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.578 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 16.5 pt20 -69.13 -27.74 65.84 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.611 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.672 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -66.63 -33.44 84.47 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 178.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.45 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 83.5 mt-30 -72.52 -41.93 65.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.403 -0.399 . . . . 0.0 111.181 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.584 HG11 HD12 ' B' ' 55' ' ' LEU . 0.2 OUTLIER -72.38 -30.14 33.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.828 -179.399 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.672 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.0 pt20 -66.6 -43.33 85.15 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.106 -0.237 . . . . 0.0 110.503 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.45 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 8.3 p-80 -79.9 -16.67 54.88 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 119.939 -0.705 . . . . 0.0 111.433 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.649 ' HG ' ' CE2' ' A' ' 26' ' ' PHE . 1.3 mp -75.2 -42.39 55.72 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.09 -50.67 70.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.673 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.21 -43.88 95.59 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.357 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.584 ' HA ' ' HD2' ' C' ' 109' ' ' TYR . 1.6 m-85 -52.14 -30.42 26.46 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.942 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.9 t -49.94 -33.78 18.6 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.979 0.419 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.414 ' O ' ' HE2' ' C' ' 111' ' ' LYS . 97.1 mm-40 -87.46 -45.85 10.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.728 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 43.5 m-85 -64.28 -20.53 66.13 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.933 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -56.2 -28.0 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -105.23 32.07 4.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.947 0.879 . . . . 0.0 109.758 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.737 HG21 ' HA ' ' A' ' 33' ' ' GLU . 59.8 t -128.04 -23.96 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.2 -1.363 . . . . 0.0 110.479 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.807 ' HG3' ' H ' ' C' ' 114' ' ' LEU . 3.6 pt-20 -66.49 -60.44 2.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.875 0.845 . . . . 0.0 112.879 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.807 ' H ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.843 0 CA-C-N 113.859 -1.519 . . . . 0.0 115.04 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.8 t . . . . . 0 N--CA 1.453 -0.299 0 CA-C-O 120.787 0.327 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.44 -33.25 74.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.084 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.739 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 7.9 t -68.14 -20.8 64.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.673 HD11 HG21 ' B' ' 52' ' ' VAL . 59.2 tp -76.2 -28.14 57.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.152 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.642 ' HE ' HD13 ' C' ' 88' ' ' LEU . 23.6 mmm-85 -62.91 -43.67 98.16 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.739 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.49 -37.09 82.33 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.566 178.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' SER . 84.7 mt-30 -63.33 -33.77 76.26 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 121.529 0.68 . . . . 0.0 109.469 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.677 HG21 HD11 ' C' ' 88' ' ' LEU . 54.1 t -72.11 -35.08 52.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.469 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 97.7 mt-10 -66.35 -26.2 67.17 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.387 0.613 . . . . 0.0 109.545 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -69.43 -53.15 20.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.221 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.638 HD11 ' HA ' ' B' ' 56' ' ' GLN . 4.0 mm? -56.52 -35.31 67.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.461 178.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.649 ' HA ' HD11 ' C' ' 95' ' ' LEU . 21.6 tt0 -71.3 -43.43 67.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.152 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.59 -31.83 76.22 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.871 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.579 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 58.9 mt-30 -75.27 -41.92 56.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.829 0.347 . . . . 0.0 111.167 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.4 p -73.95 -27.4 22.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.59 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 17.8 pt20 -74.11 -40.01 62.97 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.571 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.3 p-80 -80.95 -19.9 43.17 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.602 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.724 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.8 mp -79.85 -33.99 39.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.642 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.701 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.4 tm0? -74.46 -30.2 61.77 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.3 -62.68 1.7 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.775 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -58.41 -43.29 88.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.371 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.62 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -53.86 -32.06 51.75 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.074 -179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.5 t -50.51 -33.92 23.3 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.712 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.7 mt-30 -82.7 -46.78 12.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.236 0.541 . . . . 0.0 110.981 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.66 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 24.9 m-85 -71.29 -18.86 62.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.098 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' A' ' 30' ' ' LYS . 14.2 tmtt? -72.91 -25.71 61.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.752 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.712 ' HE2' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.73 29.49 6.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.724 0.773 . . . . 0.0 109.347 177.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.623 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 8.8 t -95.27 -36.79 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.01 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.55 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 14.1 tt0 -95.2 101.05 12.77 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.744 1.259 . . . . 0.0 111.11 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.55 ' HG ' ' C ' ' A' ' 33' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.295 -1.781 0 CA-C-N 112.738 -2.028 . . . . 0.0 109.365 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.859 0.362 . . . . 0.0 110.729 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.56 -33.1 74.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.75 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 8.2 t -68.81 -20.29 64.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.528 0.68 . . . . 0.0 109.277 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.707 HD11 HG21 ' C' ' 92' ' ' VAL . 59.4 tp -76.0 -28.51 57.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.139 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.671 ' HE ' HD13 ' A' ' 8' ' ' LEU . 23.6 mmm-85 -62.88 -43.76 97.92 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.75 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -67.73 -36.59 80.86 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.649 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 47' ' ' SER . 86.1 mt-30 -63.46 -33.54 75.78 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.547 0.689 . . . . 0.0 109.325 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.673 HG21 HD11 ' A' ' 8' ' ' LEU . 63.1 t -73.05 -34.68 46.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.128 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 96.7 mt-10 -66.17 -25.71 67.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.494 0.664 . . . . 0.0 109.241 178.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.06 -52.91 20.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.679 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.635 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.24 -34.82 68.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.265 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.638 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.5 tt0 -71.48 -43.14 67.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.216 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.419 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -60.6 -32.37 78.1 Favored Glycine 0 C--N 1.319 -0.415 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.592 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.583 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 58.9 mt-30 -74.89 -41.63 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.824 0.345 . . . . 0.0 111.418 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.486 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.1 p -74.14 -26.73 21.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.586 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.419 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 17.2 pt20 -74.46 -40.8 61.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.563 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.583 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.5 p-80 -80.16 -19.89 46.12 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.665 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' C' ' 103' ' ' GLN . 1.8 mp -79.51 -34.16 41.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.23 -0.588 . . . . 0.0 109.644 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.724 ' HG2' HD11 ' A' ' 22' ' ' LEU . 4.8 tm0? -74.34 -30.63 62.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.9 -63.17 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.025 -1.443 . . . . 0.0 109.751 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.641 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -57.24 -43.7 83.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.225 178.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.633 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -53.64 -32.64 52.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.012 -179.613 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.7 t -50.41 -32.58 18.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.855 0.36 . . . . 0.0 110.999 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.753 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 8.2 mt-30 -84.31 -46.65 11.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.171 0.51 . . . . 0.0 110.883 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.641 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 22.8 m-85 -70.88 -19.11 62.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.031 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.452 ' O ' ' HD3' ' B' ' 70' ' ' LYS . 14.0 tmtt? -73.04 -24.78 60.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.981 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -107.53 29.65 7.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.952 0.882 . . . . 0.0 109.45 176.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.62 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 8.1 t -95.24 -37.56 7.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.107 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.534 ' C ' ' HG ' ' B' ' 74' ' ' LEU . 14.2 tt0 -95.11 99.94 11.84 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 111.06 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.534 ' HG ' ' C ' ' B' ' 73' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.297 -1.692 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.826 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 86.2 t . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.819 0.342 . . . . 0.0 110.779 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.569 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.53 -32.31 73.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.772 0.32 . . . . 0.0 111.497 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.735 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 7.9 t -69.27 -20.61 63.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.639 0.733 . . . . 0.0 109.209 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.677 HD11 HG21 ' A' ' 12' ' ' VAL . 59.6 tp -75.78 -27.75 58.12 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.218 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.672 ' HE ' HD13 ' B' ' 48' ' ' LEU . 23.4 mmm-85 -63.37 -43.6 97.19 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.735 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.5 -35.59 77.72 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.46 179.067 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' C' ' 87' ' ' SER . 85.4 mt-30 -64.07 -33.41 75.69 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 109.376 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.707 HG21 HD11 ' B' ' 48' ' ' LEU . 54.8 t -72.54 -35.65 51.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.256 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 96.6 mt-10 -65.24 -27.54 68.73 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -68.34 -53.08 26.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.854 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.649 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.4 -34.84 69.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.294 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.635 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.4 tt0 -71.12 -42.81 68.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.169 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.49 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.03 -31.67 77.46 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.86 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.612 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 57.9 mt-30 -75.41 -41.67 55.5 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.558 -0.378 . . . . 0.0 111.132 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -73.96 -27.15 21.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.488 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.49 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 15.6 pt20 -74.12 -41.68 61.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 121.11 -0.236 . . . . 0.0 110.505 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.612 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.6 p-80 -79.29 -19.98 49.13 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.596 -0.842 . . . . 0.0 110.841 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' A' ' 23' ' ' GLN . 1.8 mp -79.37 -34.68 41.77 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.71 ' HG2' HD11 ' B' ' 62' ' ' LEU . 4.3 tm0? -73.81 -31.3 63.17 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 177.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.48 -63.06 1.41 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.678 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -57.82 -43.68 85.92 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.185 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.63 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -53.48 -32.34 49.72 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.384 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 45.9 t -50.91 -33.95 26.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.164 0.507 . . . . 0.0 110.815 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.739 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 8.3 mt-30 -81.99 -46.95 13.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.178 0.514 . . . . 0.0 110.908 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.648 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 26.4 m-85 -70.68 -18.93 62.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.138 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' C' ' 110' ' ' LYS . 14.3 tmtt? -73.38 -24.92 60.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.905 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.739 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -107.21 28.12 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.791 0.805 . . . . 0.0 109.39 176.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.625 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 7.8 t -94.08 -36.9 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.08 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.489 ' HB2' HG21 ' B' ' 72' ' ' VAL . 9.0 tt0 -96.39 102.42 14.21 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.651 1.215 . . . . 0.0 110.808 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.292 -1.933 0 CA-C-N 112.548 -2.115 . . . . 0.0 110.022 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 58.5 t . . . . . 0 C--O 1.233 0.216 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.727 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.74 -30.4 71.5 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.622 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 44.4 t -63.96 -30.2 71.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.673 0.749 . . . . 0.0 109.293 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.585 ' O ' HG13 ' A' ' 12' ' ' VAL . 59.2 tp -73.32 -25.73 60.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -69.03 -21.57 64.11 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.622 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.7 mt-30 -75.62 -40.53 56.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -69.23 -26.24 64.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.283 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 8' ' ' LEU . 15.2 m -78.21 -33.84 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.236 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.507 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 62.7 mm-40 -65.52 -34.4 78.16 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.89 6.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.952 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.598 HD11 HG11 ' B' ' 59' ' ' VAL . 41.8 tp -59.06 -39.34 81.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.742 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.546 ' HA ' HG12 ' A' ' 19' ' ' VAL . 18.0 pt20 -70.08 -23.28 63.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.649 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -68.72 -31.17 72.93 Favored Glycine 0 C--O 1.239 0.428 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.935 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.695 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.1 mm100 -73.27 -49.08 29.62 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.441 0.638 . . . . 0.0 110.629 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.588 HG11 HD11 ' C' ' 95' ' ' LEU . 7.7 p -70.02 -26.34 29.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 C-N-CA 120.226 -0.59 . . . . 0.0 112.027 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -71.66 -42.46 67.49 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.142 -0.349 . . . . 0.0 110.376 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.455 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.0 p-80 -76.2 -18.13 59.21 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.613 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 18.6 mt -74.08 -39.86 63.14 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.696 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -69.4 -34.23 74.19 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.086 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -54.78 -63.62 1.09 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.289 177.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -59.18 -40.47 85.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.681 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -55.16 -30.82 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.112 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -58.17 -31.52 67.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -88.56 -15.56 34.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.154 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.557 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.0 m-85 -99.96 -15.29 18.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.606 0.717 . . . . 0.0 110.543 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HG2' ' OH ' ' C' ' 109' ' ' TYR . 1.4 tmtp? -64.46 -33.22 75.38 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.793 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -101.38 23.77 10.56 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.253 0.549 . . . . 0.0 110.507 179.398 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.465 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 26.5 t -92.75 -26.27 4.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -64.35 -69.61 0.27 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.903 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 59.8 t . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.717 0.294 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.45 -30.29 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.036 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.611 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 47.1 t -63.59 -30.55 71.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.638 0.733 . . . . 0.0 109.101 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.567 ' O ' HG13 ' B' ' 52' ' ' VAL . 57.7 tp -73.84 -25.69 60.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.57 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -69.37 -20.29 63.83 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.8 mt-30 -77.03 -40.1 47.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -69.73 -26.61 64.41 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.985 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.567 HG13 ' O ' ' B' ' 48' ' ' LEU . 17.5 m -77.54 -34.32 20.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.302 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.526 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 62.9 mm-40 -65.12 -34.33 78.13 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.75 -59.34 5.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.865 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.559 HD11 HG21 ' C' ' 99' ' ' VAL . 45.4 tp -58.98 -39.11 80.76 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.961 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.554 ' HA ' HG12 ' B' ' 59' ' ' VAL . 17.4 pt20 -70.2 -23.36 62.93 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.623 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -69.36 -29.42 71.81 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.881 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.715 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.1 mm100 -74.35 -48.21 29.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.365 0.603 . . . . 0.0 110.784 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.598 HG11 HD11 ' A' ' 15' ' ' LEU . 6.9 p -70.75 -26.55 28.34 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.713 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.576 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -71.6 -41.99 68.27 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.361 178.409 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.2 p-80 -76.33 -19.57 58.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.595 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 17.8 mt -72.1 -40.8 67.94 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.627 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -69.23 -34.07 74.27 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -54.7 -63.14 1.25 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.254 178.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.571 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.64 -39.87 85.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.579 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.534 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.86 -30.04 60.87 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.17 -179.33 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.6 t -59.6 -29.78 68.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.286 0.565 . . . . 0.0 110.79 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -89.07 -15.81 33.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.365 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.571 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 39.2 m-85 -100.66 -15.81 17.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.647 0.737 . . . . 0.0 110.454 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' OH ' ' A' ' 29' ' ' TYR . 1.3 tmtp? -64.5 -32.51 74.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.7 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -101.61 23.8 10.68 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.731 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.475 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 33.4 t -93.07 -26.54 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -64.3 -68.43 0.35 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.938 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -177.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.45 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 62.2 t . . . . . 0 N--CA 1.453 -0.314 0 CA-C-O 120.757 0.313 . . . . 0.0 110.987 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.776 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.65 -28.43 69.61 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 40.9 t -66.38 -29.66 69.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.596 0.712 . . . . 0.0 109.289 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 62.2 tp -73.66 -24.09 59.94 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.909 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.776 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -68.61 -23.32 64.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.2 mt-30 -75.87 -41.29 52.66 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -69.09 -23.55 64.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.019 178.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.59 -40.81 28.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.277 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.512 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 55.4 mm-40 -64.55 -33.09 75.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.055 0.931 . . . . 0.0 108.56 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.84 6.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.139 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.588 HD11 HG11 ' A' ' 19' ' ' VAL . 42.0 tp -59.52 -40.61 87.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.773 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.618 ' HA ' HG23 ' C' ' 99' ' ' VAL . 17.9 pt20 -68.02 -24.15 65.08 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.575 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -67.39 -30.95 75.81 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.096 -1.05 . . . . 0.0 110.949 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.687 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 9.6 mm100 -72.54 -46.51 54.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.801 0.334 . . . . 0.0 110.269 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.618 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -66.75 -34.69 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.53 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.85 -41.48 87.29 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.675 -177.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.475 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 5.4 p-80 -77.64 -19.81 54.86 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.101 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.696 HD21 ' HG2' ' A' ' 23' ' ' GLN . 18.1 mt -73.45 -40.3 64.3 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -69.82 -34.17 73.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.328 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -54.76 -63.18 1.23 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.059 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.569 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.14 -40.15 84.62 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.853 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.63 -31.43 62.3 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.091 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 33.7 t -57.58 -29.21 64.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.158 0.504 . . . . 0.0 110.632 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -90.81 -15.65 29.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.592 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.569 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 41.1 m-85 -100.78 -16.07 17.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.499 0.666 . . . . 0.0 110.642 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.441 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -67.47 -26.73 66.52 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.972 -179.143 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER -104.38 22.43 14.89 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.176 177.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 37.2 t -92.13 -26.3 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 9.3 tm-20 -64.28 -68.05 0.38 Allowed 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.905 HD13 ' H ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.651 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 -177.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.576 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 91.1 t . . . . . 0 N--CA 1.455 -0.217 0 CA-C-O 120.755 0.312 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.09 -32.43 73.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.841 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.702 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 34.5 m -71.4 -23.11 61.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.857 0.837 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.406 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 62.0 tp -77.89 -22.53 49.62 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.676 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -64.14 -44.13 93.13 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.056 178.227 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.702 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -70.39 -47.22 61.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.269 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -61.64 -39.12 90.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.241 0.543 . . . . 0.0 110.838 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 2.6 t -73.2 -27.38 24.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.958 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.723 ' HA ' HE21 ' A' ' 16' ' ' GLN . 19.1 tt0 -67.31 -33.64 75.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.66 -60.83 2.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.632 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 15' ' ' LEU . 3.4 mm? -57.32 -37.21 72.13 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.371 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.723 HE21 ' HA ' ' A' ' 13' ' ' GLU . 21.8 pt20 -72.16 -30.41 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.43 -30.32 77.31 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.756 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 76.4 mt-30 -70.56 -48.36 55.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.896 -0.652 . . . . 0.0 110.669 178.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.93 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 10.5 pt20 -59.79 -43.35 94.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.316 -178.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 5.1 p-80 -79.11 -14.55 59.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.544 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -75.66 -42.43 51.33 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.73 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.1 tm0? -68.77 -38.97 80.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.05 72.32 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.484 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.59 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.31 -47.15 85.53 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.118 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.44 ' CD2' HD22 ' C' ' 102' ' ' LEU . 5.5 m-85 -50.3 -25.77 4.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 47.7 t -49.64 -30.0 8.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.634 ' HG3' ' OE1' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -107.84 -11.62 15.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' B' ' 70' ' ' LYS . 55.0 m-85 -94.94 -21.87 18.35 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.771 -0.581 . . . . 0.0 109.696 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HA ' ' CE2' ' C' ' 109' ' ' TYR . 22.7 pttp -59.64 -21.15 60.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.746 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -103.97 33.55 3.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.444 178.316 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.691 HG12 HG11 ' C' ' 112' ' ' VAL . 71.1 t -124.91 -24.87 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.963 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.78 ' HG3' HD13 ' A' ' 34' ' ' LEU . 16.9 pt-20 -61.76 -40.77 96.29 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.78 HD13 ' HG3' ' A' ' 33' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.507 -0.679 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -176.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.59 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 99.1 t . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.7 -31.84 72.08 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.819 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 40.5 m -71.47 -23.78 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.678 0.751 . . . . 0.0 109.297 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.401 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 64.4 tp -77.57 -22.29 51.19 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 0.0 OUTLIER -63.94 -44.66 92.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.071 178.045 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.0 OUTLIER -69.93 -47.69 61.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -61.3 -38.55 87.2 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.455 0.645 . . . . 0.0 110.912 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.401 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 2.6 t -74.03 -27.28 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.105 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.736 ' HA ' HE21 ' B' ' 56' ' ' GLN . 22.0 tt0 -67.3 -33.01 74.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.16 -59.83 3.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.835 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' B' ' 55' ' ' LEU . 3.4 mm? -58.55 -37.25 75.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.706 -1.134 . . . . 0.0 112.105 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.736 HE21 ' HA ' ' B' ' 53' ' ' GLU . 21.9 pt20 -71.83 -30.09 65.11 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.632 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.401 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -65.44 -31.82 81.51 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.79 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 76.4 mt-30 -69.85 -47.23 63.49 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.928 -0.636 . . . . 0.0 110.727 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.451 HG23 ' HA ' ' B' ' 56' ' ' GLN . 0.9 OUTLIER -63.12 -44.62 99.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.693 -179.319 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 11.0 pt20 -59.26 -42.44 91.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.6 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.443 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -80.31 -15.07 57.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.288 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.3 mt -74.82 -42.16 58.57 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 1.9 tm0? -69.12 -38.82 79.1 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.71 -48.94 71.85 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.202 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -60.95 -47.49 86.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.099 178.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.425 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.3 m-85 -50.38 -26.15 4.65 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . 0.453 ' O ' ' HE3' ' B' ' 70' ' ' LYS . 46.7 t -49.55 -30.11 8.0 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.633 ' HG3' ' OE1' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -108.25 -9.34 15.53 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.557 ' HE1' ' HB1' ' B' ' 65' ' ' ALA . 60.6 m-85 -97.27 -21.41 17.27 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.532 ' HA ' ' CE2' ' A' ' 29' ' ' TYR . 22.6 pttp -59.16 -22.05 60.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.668 -178.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -103.5 33.77 3.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.537 0.684 . . . . 0.0 110.584 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.721 HG11 HG12 ' C' ' 112' ' ' VAL . 72.1 t -125.29 -24.27 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.835 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.806 ' HG3' HD13 ' B' ' 74' ' ' LEU . 17.1 pt-20 -61.8 -40.39 95.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.806 HD13 ' HG3' ' B' ' 73' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.605 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 93.2 t . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.14 -31.93 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.734 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.704 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 22.5 m -71.75 -23.87 61.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.811 0.815 . . . . 0.0 109.545 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.41 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 62.9 tp -77.42 -22.32 51.72 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.7 ' HB2' ' O ' ' C' ' 86' ' ' ALA . 0.0 OUTLIER -64.39 -43.24 95.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.252 178.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.1 pt20 -71.46 -47.35 56.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.196 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -61.31 -39.07 89.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.217 0.532 . . . . 0.0 111.005 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 2.6 t -73.31 -27.81 24.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.068 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.753 ' HA ' HE21 ' C' ' 96' ' ' GLN . 22.9 tt0 -66.86 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.37 -59.98 3.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.902 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.6 mm? -58.48 -35.86 72.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.275 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.753 HE21 ' HA ' ' C' ' 93' ' ' GLU . 22.0 pt20 -73.58 -30.26 62.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.409 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.45 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.23 -29.52 75.07 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 177.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.772 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 76.3 mt-30 -72.27 -49.55 33.96 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.015 -0.593 . . . . 0.0 111.019 178.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.424 HG21 HG22 ' B' ' 59' ' ' VAL . 1.6 p -66.5 -34.61 71.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 10.4 pt20 -64.89 -43.97 91.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.554 -0.459 . . . . 0.0 111.104 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.427 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.8 p-80 -77.94 -15.13 59.24 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.83 -0.748 . . . . 0.0 111.037 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.772 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.1 mt -73.9 -41.62 61.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.2 tm0? -69.95 -37.97 76.0 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.14 74.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.379 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.598 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -61.25 -47.89 83.96 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.799 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.449 ' CD2' HD22 ' B' ' 62' ' ' LEU . 3.0 m-85 -49.6 -26.18 3.39 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . 0.467 ' O ' ' HE3' ' C' ' 110' ' ' LYS . 36.9 t -49.79 -30.52 9.79 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.629 ' HG3' ' OE1' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -106.87 -11.41 15.74 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.557 ' CE2' ' HA ' ' A' ' 30' ' ' LYS . 53.1 m-85 -94.94 -21.93 18.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.645 178.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.554 ' HA ' ' CE2' ' B' ' 69' ' ' TYR . 22.8 pttp -59.28 -21.19 59.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.003 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.09 33.52 3.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 110.325 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.721 HG12 HG11 ' B' ' 72' ' ' VAL . 70.3 t -125.29 -25.92 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.59 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.633 ' OE1' ' HG3' ' B' ' 68' ' ' GLN . 16.6 pt-20 -59.7 -42.72 93.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.314 -0.954 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -176.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.5 t . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.742 0.306 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.825 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -70.74 -20.79 62.6 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.74 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.653 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 32.1 t -67.88 -27.63 66.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.54 HD11 HG11 ' B' ' 52' ' ' VAL . 65.2 tp -74.34 -22.85 59.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.626 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.825 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 mmt85 -69.5 -22.1 63.63 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.653 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.5 mt-30 -73.75 -39.31 64.32 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 9.8 mm100 -69.52 -33.17 72.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.577 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.723 HG22 ' HA ' ' A' ' 9' ' ' ARG . 29.0 m -74.53 -31.61 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.697 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.579 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.2 mt-10 -70.43 -29.73 66.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.48 -53.03 48.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.611 177.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.523 HD11 ' HA ' ' B' ' 56' ' ' GLN . 3.9 mm? -57.71 -37.4 73.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.233 -1.349 . . . . 0.0 111.632 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.647 ' HA ' HG12 ' A' ' 19' ' ' VAL . 19.6 pt20 -76.48 -25.03 53.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.215 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.873 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -69.7 -37.52 76.63 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.801 -1.19 . . . . 0.0 110.701 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.703 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 65.4 mt-30 -72.88 -46.63 51.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.026 -0.587 . . . . 0.0 111.321 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.647 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.8 p -69.23 -32.83 55.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.693 -179.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.873 HE21 ' HA2' ' A' ' 17' ' ' GLY . 14.8 pt20 -67.55 -41.74 83.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.842 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.3 p-80 -78.61 -19.44 52.68 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.271 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.733 HD21 ' HG2' ' B' ' 63' ' ' GLN . 14.2 mt -71.95 -43.73 64.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' C' ' 102' ' ' LEU . 3.6 tm0? -70.38 -33.34 71.29 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.35 -56.05 26.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.866 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.38 -41.38 98.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.132 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.67 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.96 -26.06 59.02 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.519 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -53.43 -26.64 20.78 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.27 0.557 . . . . 0.0 110.34 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -93.02 -53.66 4.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.589 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 21.7 m-85 -63.13 -20.15 65.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.472 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -67.09 -24.27 65.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.781 0.324 . . . . 0.0 110.756 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.84 34.21 3.97 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.748 0.785 . . . . 0.0 109.708 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.605 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 10.8 t -98.78 -33.6 4.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.942 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.66 88.57 7.16 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 122.707 1.241 . . . . 0.0 111.665 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.97 0 CA-C-N 112.438 -2.165 . . . . 0.0 110.296 178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 79.1 t . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 120.924 0.392 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.798 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -70.59 -20.62 62.75 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.641 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 19.3 t -68.42 -26.8 65.72 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.551 HD11 HG11 ' C' ' 92' ' ' VAL . 63.6 tp -74.32 -23.26 59.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.522 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.798 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 9.1 mmt85 -69.26 -22.08 63.86 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.3 mt-30 -74.4 -38.16 63.19 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.475 ' O ' HD23 ' B' ' 55' ' ' LEU . 10.1 mm100 -70.57 -32.94 70.54 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.391 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' B' ' 49' ' ' ARG . 28.0 m -74.73 -31.55 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.662 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.588 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 50.7 mt-10 -70.52 -30.03 66.69 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.25 -53.09 49.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.615 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.46 -37.66 73.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.632 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.643 ' HA ' HG12 ' B' ' 59' ' ' VAL . 19.5 pt20 -76.4 -25.34 54.43 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.368 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.838 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -69.61 -37.43 77.46 Favored Glycine 0 C--O 1.242 0.6 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.663 178.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 69.3 mt-30 -72.53 -47.18 50.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.251 -0.475 . . . . 0.0 111.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' B' ' 56' ' ' GLN . 15.0 p -68.74 -32.57 55.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 C-N-CA 120.305 -0.558 . . . . 0.0 112.012 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.838 HE21 ' HA2' ' B' ' 57' ' ' GLY . 13.7 pt20 -68.23 -40.91 81.9 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.965 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.2 p-80 -79.18 -19.14 51.63 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.728 HD21 ' HG2' ' C' ' 103' ' ' GLN . 14.6 mt -72.33 -43.19 64.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.733 ' HG2' HD21 ' A' ' 22' ' ' LEU . 3.4 tm0? -70.85 -33.75 70.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.92 -56.39 22.32 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.913 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.756 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.45 -40.77 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.092 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.689 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -57.46 -26.05 60.63 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.485 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t -53.67 -26.64 23.44 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.166 0.508 . . . . 0.0 110.459 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -92.29 -54.84 3.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.459 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.756 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -62.03 -20.12 63.61 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -67.03 -23.46 65.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.849 -179.288 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 33.14 4.74 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.621 0.724 . . . . 0.0 109.678 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.632 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 16.2 t -97.1 -34.45 4.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.206 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -89.97 89.57 7.78 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 122.549 1.166 . . . . 0.0 111.414 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.424 ' N ' HD22 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.292 -1.896 0 CA-C-N 112.486 -2.143 . . . . 0.0 110.393 178.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 69.1 t . . . . . 0 N--CA 1.452 -0.362 0 CA-C-O 120.789 0.328 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.828 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -70.5 -20.82 62.81 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 25.0 t -67.94 -27.35 66.54 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 12' ' ' VAL . 65.8 tp -74.26 -22.8 59.16 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.761 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.828 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 9.0 mmt85 -69.59 -22.48 63.51 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.6 mt-30 -74.26 -37.21 63.82 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.469 ' O ' HD23 ' C' ' 95' ' ' LEU . 10.2 mm100 -71.63 -32.75 68.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.29 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.746 HG22 ' HA ' ' C' ' 89' ' ' ARG . 27.5 m -74.63 -31.83 27.97 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.609 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.552 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 49.5 mt-10 -69.72 -30.72 68.41 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.03 -52.98 52.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.777 -1.102 . . . . 0.0 109.706 177.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.517 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.6 -37.69 73.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.696 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.664 ' HA ' HG12 ' C' ' 99' ' ' VAL . 19.5 pt20 -76.23 -25.15 54.76 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.318 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.832 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -69.69 -37.2 76.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 119.9 -1.143 . . . . 0.0 110.729 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.709 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 68.1 mt-30 -73.34 -46.26 50.28 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.419 . . . . 0.0 111.22 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.664 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.7 p -69.45 -32.47 53.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.667 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.832 HE21 ' HA2' ' C' ' 97' ' ' GLY . 15.4 pt20 -67.84 -42.17 81.83 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.866 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.1 p-80 -78.43 -18.88 54.31 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.454 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.729 HD21 ' HG2' ' A' ' 23' ' ' GLN . 14.3 mt -72.4 -43.59 63.69 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 177.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.728 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.0 tm0? -70.12 -34.19 72.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 178.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.63 -55.86 28.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.24 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.742 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.45 -40.8 98.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.829 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.695 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -57.57 -24.43 56.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.728 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 31.5 t -55.46 -26.46 42.4 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 110.391 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -92.78 -52.94 4.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.272 178.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.742 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 22.0 m-85 -63.18 -20.51 65.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 0.1 OUTLIER -66.49 -25.91 66.93 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.837 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.531 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -107.66 35.08 3.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.832 0.825 . . . . 0.0 109.949 178.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.566 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 12.6 t -99.42 -35.83 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.166 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.563 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 27.1 tt0 -88.92 90.46 8.42 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 122.681 1.229 . . . . 0.0 111.141 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.563 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.296 -1.746 0 CA-C-N 112.581 -2.1 . . . . 0.0 109.421 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 60.1 t . . . . . 0 CA--C 1.52 -0.179 0 N-CA-C 110.861 -0.051 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.82 95.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.89 0.376 . . . . 0.0 111.416 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 23.4 m -63.7 -31.03 72.07 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 122.095 0.95 . . . . 0.0 110.353 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HG21 ' B' ' 52' ' ' VAL . 37.0 tp -75.18 -54.54 6.95 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.81 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.878 ' HB3' HD22 ' C' ' 88' ' ' LEU . 0.0 OUTLIER -58.26 -28.58 65.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 123.44 0.463 . . . . 0.0 112.067 -179.024 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.7 pt20 -70.63 -42.4 70.94 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -65.63 -10.3 34.64 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.948 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.92 HG21 HD11 ' C' ' 88' ' ' LEU . 15.7 t -78.57 -38.57 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-O 120.458 0.17 . . . . 0.0 110.769 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 21.9 pt-20 -73.26 -19.17 61.12 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.9 -49.63 23.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.513 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' B' ' 55' ' ' LEU . 10.4 tp -61.71 -33.58 74.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.351 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.593 ' HA ' HD21 ' C' ' 95' ' ' LEU . 1.9 tp-100 -68.53 -42.32 78.65 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.581 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.65 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.77 -30.04 71.71 Favored Glycine 0 C--O 1.236 0.235 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.513 ' HA ' ' ND1' ' A' ' 21' ' ' HIS . 73.5 mt-30 -73.31 -47.4 42.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.263 0.554 . . . . 0.0 110.834 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.1 p -69.64 -26.41 30.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.337 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 1.7 pt20 -73.6 -39.58 64.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.513 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 9.7 p-80 -80.44 -12.29 59.58 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.02 -0.672 . . . . 0.0 109.783 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.683 HD21 ' HG2' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -76.01 -39.21 56.24 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 176.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.929 ' HG2' HD11 ' C' ' 102' ' ' LEU . 69.8 mt-30 -70.74 -31.13 67.85 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.24 -44.17 97.17 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.642 177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.624 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.18 -49.67 76.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.732 178.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.494 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 6.5 m-85 -54.96 -25.71 31.54 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.984 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -51.63 -31.8 26.66 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 110.748 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.422 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 76.0 mt-30 -88.55 -54.58 4.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.371 0.605 . . . . 0.0 110.502 178.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.679 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.4 m-85 -63.74 -19.46 64.97 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 21.0 ptmt -68.91 -30.29 68.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.611 0.243 . . . . 0.0 110.883 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -102.15 28.16 6.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.899 0.857 . . . . 0.0 109.813 178.394 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.679 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 24.4 t -94.03 -44.34 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.577 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 5.6 tt0 -111.6 109.76 19.82 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 122.276 1.036 . . . . 0.0 110.065 177.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.604 0 CA-C-N 113.013 -1.903 . . . . 0.0 109.434 -179.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 58.2 t . . . . . 0 C--O 1.224 -0.239 0 N-CA-C 111.194 0.072 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -41.04 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 0.0 111.244 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' B' ' 50' ' ' GLN . 35.2 m -63.72 -31.38 72.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.259 1.028 . . . . 0.0 110.241 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.969 HD11 HG21 ' C' ' 92' ' ' VAL . 34.5 tp -75.07 -54.91 6.34 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.827 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.916 ' HB3' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -57.61 -28.96 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.465 0.478 . . . . 0.0 111.969 -178.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' B' ' 53' ' ' GLU . 2.6 pt20 -70.43 -42.87 71.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.59 -10.58 36.73 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.629 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.958 HG21 HD11 ' A' ' 8' ' ' LEU . 16.2 t -78.18 -37.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.961 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' B' ' 50' ' ' GLN . 22.9 pt-20 -74.08 -18.69 60.78 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -48.52 27.46 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.184 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.832 HD21 ' HB3' ' C' ' 95' ' ' LEU . 10.8 tp -62.66 -32.86 73.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -69.42 -42.65 74.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.577 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.632 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.99 -30.26 69.66 Favored Glycine 0 CA--C 1.52 0.375 0 N-CA-C 111.124 -0.791 . . . . 0.0 111.124 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.511 ' HA ' ' ND1' ' B' ' 61' ' ' HIS . 73.3 mt-30 -72.62 -48.86 36.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.341 0.591 . . . . 0.0 111.046 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 2.4 p -69.14 -26.2 31.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.254 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 1.7 pt20 -73.59 -39.48 64.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.511 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 9.5 p-80 -80.63 -11.4 59.65 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.813 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.594 HD21 ' HG2' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -76.46 -38.83 54.79 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 176.132 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.683 ' HG2' HD21 ' A' ' 22' ' ' LEU . 70.8 mt-30 -70.76 -31.27 68.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 177.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.56 96.35 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.542 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.82 -49.65 76.63 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.879 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.617 ' HE2' HD13 ' A' ' 22' ' ' LEU . 6.7 m-85 -55.56 -25.37 37.54 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.898 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.2 t -52.3 -31.13 31.52 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 118.045 0.384 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.434 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 76.8 mt-30 -88.56 -54.48 4.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.33 0.585 . . . . 0.0 110.621 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.685 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.9 m-85 -63.66 -20.05 65.39 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.563 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 21.1 ptmt -68.55 -30.5 69.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.645 0.26 . . . . 0.0 110.89 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.642 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.38 26.48 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.644 0.735 . . . . 0.0 110.068 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.685 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 25.0 t -92.47 -44.14 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.953 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 10.0 tt0 -112.28 109.93 19.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.32 1.057 . . . . 0.0 109.787 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.551 HD13 ' HA ' ' B' ' 71' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.628 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.161 -178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 66.4 t . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 110.863 -0.051 . . . . 0.0 110.863 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.511 ' O ' ' HG2' ' C' ' 90' ' ' GLN . . . -63.85 -43.31 96.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 110.97 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 40.6 m -62.47 -30.58 71.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.937 0.875 . . . . 0.0 110.649 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.92 HD11 HG21 ' A' ' 12' ' ' VAL . 32.8 tp -76.85 -53.53 7.78 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.778 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.886 ' HB3' HD22 ' B' ' 48' ' ' LEU . 0.0 OUTLIER -57.83 -29.52 65.01 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.528 0.518 . . . . 0.0 111.708 -179.033 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' C' ' 93' ' ' GLU . 2.9 pt20 -69.72 -43.28 72.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 176.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 71.9 mt-30 -64.42 -11.82 37.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.915 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.969 HG21 HD11 ' B' ' 48' ' ' LEU . 17.2 t -77.36 -38.85 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 O-C-N 122.346 -0.221 . . . . 0.0 111.141 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' C' ' 90' ' ' GLN . 21.8 pt-20 -73.51 -17.21 61.24 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -74.86 -49.38 20.7 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.35 177.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.832 ' HB3' HD21 ' B' ' 55' ' ' LEU . 3.3 mt -59.76 -37.1 78.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.617 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -66.07 -40.81 91.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.622 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.618 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -61.38 -30.28 73.81 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.524 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 73.4 mt-30 -73.59 -47.86 37.14 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.751 -0.264 . . . . 0.0 110.578 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.491 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -65.9 -32.31 57.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.389 179.334 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 1.7 pt20 -68.36 -39.73 81.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -178.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.524 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 13.0 p-80 -81.43 -10.54 59.49 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.795 178.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.929 HD11 ' HG2' ' A' ' 23' ' ' GLN . 0.8 OUTLIER -81.4 -33.5 32.19 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.594 ' HG2' HD21 ' B' ' 62' ' ' LEU . 71.5 mt-30 -74.45 -29.52 61.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 175.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -62.99 -44.91 94.72 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.478 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.92 -49.99 75.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.688 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.539 ' CE2' HD13 ' B' ' 62' ' ' LEU . 6.5 m-85 -55.04 -25.73 32.56 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.092 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.6 t -51.69 -30.47 22.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.105 0.411 . . . . 0.0 110.594 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.439 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 77.0 mt-30 -89.66 -54.6 3.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.556 0.693 . . . . 0.0 110.678 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.677 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -63.46 -20.2 65.38 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.985 -1.007 . . . . 0.0 113.56 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.569 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 21.3 ptmt -68.37 -30.03 68.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 111.154 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.99 27.04 6.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.693 0.759 . . . . 0.0 109.924 178.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.677 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 24.9 t -92.94 -44.22 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.903 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.642 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 6.2 tt0 -112.31 109.54 19.24 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.164 0.983 . . . . 0.0 109.838 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.653 0 CA-C-N 113.033 -1.894 . . . . 0.0 108.977 -178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 120.803 0.335 . . . . 0.0 110.437 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.78 -37.38 86.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.894 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.748 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -65.96 -22.9 66.5 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.585 0.707 . . . . 0.0 109.899 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.751 ' O ' HG23 ' A' ' 12' ' ' VAL . 52.7 tp -75.91 -30.57 58.8 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.231 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.542 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mmm-85 -62.88 -39.62 95.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.748 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.48 -37.21 79.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.59 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 7' ' ' SER . 82.7 mt-30 -64.24 -30.0 71.07 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.213 0.53 . . . . 0.0 109.868 178.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 8' ' ' LEU . 83.4 t -72.68 -40.27 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.501 ' HA ' HE21 ' A' ' 16' ' ' GLN . 13.8 tp10 -63.25 -33.99 76.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 122.159 0.981 . . . . 0.0 108.779 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.01 -61.29 2.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.087 -1.415 . . . . 0.0 111.268 178.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.516 HD21 HG11 ' B' ' 59' ' ' VAL . 2.6 tm? -59.51 -38.87 82.08 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.416 -1.266 . . . . 0.0 111.662 -178.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 22.5 pt20 -70.77 -23.32 62.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.436 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.651 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.36 -27.55 73.54 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.035 -1.078 . . . . 0.0 110.44 177.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 80.1 mm-40 -75.04 -48.12 25.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.086 0.47 . . . . 0.0 110.71 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' GLN . 2.4 p -67.97 -33.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.817 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.651 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 11.2 pt20 -66.32 -43.92 84.85 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.877 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.502 ' N ' ' HG3' ' A' ' 20' ' ' GLN . 7.8 p-80 -76.34 -16.08 59.83 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.747 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.9 mt -73.3 -36.93 66.36 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.535 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.8 tm0? -70.99 -33.98 70.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.41 -51.91 67.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.704 177.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.711 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.58 -38.6 90.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.507 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.429 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -55.7 -30.03 60.41 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.369 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 t -49.22 -27.3 3.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.993 0.425 . . . . 0.0 111.13 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -96.04 -45.61 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 22.4 m-85 -68.42 -21.51 64.66 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 45.9 mtpt -71.21 -28.68 64.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.721 0.295 . . . . 0.0 111.159 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.447 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -100.17 30.31 3.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.665 0.745 . . . . 0.0 109.677 178.592 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.565 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 13.0 t -95.66 -42.56 12.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.952 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.54 ' HB2' HG22 ' C' ' 112' ' ' VAL . 18.9 tt0 -103.44 101.87 11.77 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.086 0.946 . . . . 0.0 111.034 178.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.297 -1.683 0 CA-C-N 112.905 -1.952 . . . . 0.0 110.291 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 87.1 t . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.739 0.304 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.535 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -65.72 -37.55 86.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.195 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.734 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 51.1 m -66.25 -22.29 66.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.641 0.734 . . . . 0.0 109.76 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.738 ' O ' HG23 ' B' ' 52' ' ' VAL . 50.6 tp -75.93 -31.12 58.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.321 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.536 ' HE ' HD13 ' A' ' 8' ' ' LEU . 16.7 mmm-85 -62.75 -39.74 95.08 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.734 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -68.0 -37.72 81.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.717 178.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' B' ' 47' ' ' SER . 82.3 mt-30 -63.99 -30.21 71.3 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.459 0.647 . . . . 0.0 109.889 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 48' ' ' LEU . 77.6 t -71.72 -41.48 70.71 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.046 179.211 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.521 ' HA ' HE21 ' B' ' 56' ' ' GLN . 15.1 tp10 -62.04 -33.57 74.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.218 1.009 . . . . 0.0 108.93 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.71 -60.67 2.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.465 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.406 HD21 HG21 ' C' ' 99' ' ' VAL . 2.6 tm? -59.99 -38.87 83.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.568 -1.197 . . . . 0.0 111.571 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' B' ' 59' ' ' VAL . 22.3 pt20 -70.27 -24.41 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.384 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.64 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -66.99 -26.7 73.27 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 119.924 -1.131 . . . . 0.0 110.441 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 80.9 mm-40 -75.86 -48.6 20.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.317 0.58 . . . . 0.0 110.72 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' B' ' 56' ' ' GLN . 2.4 p -67.93 -31.69 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.687 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.64 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.7 pt20 -67.74 -43.67 79.38 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.785 178.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.526 ' N ' ' HG3' ' B' ' 60' ' ' GLN . 7.7 p-80 -76.47 -14.92 60.01 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 119.51 -0.876 . . . . 0.0 110.657 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.6 mt -74.57 -37.9 62.83 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 176.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.554 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.1 tm0? -70.29 -33.8 71.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 177.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.46 -51.0 71.71 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.787 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.704 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.89 -38.84 92.51 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.572 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.421 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.3 OUTLIER -56.07 -29.55 60.69 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.269 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -50.07 -26.37 4.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.082 0.468 . . . . 0.0 110.841 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -96.34 -46.29 6.46 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.621 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.704 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -68.54 -21.14 64.57 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 48.0 mtpt -71.63 -27.3 63.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.744 0.307 . . . . 0.0 110.982 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.485 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.66 30.9 4.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.724 0.773 . . . . 0.0 109.649 178.209 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.582 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 12.6 t -96.24 -42.94 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.794 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.498 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 20.3 tt0 -103.32 101.74 11.68 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.13 0.967 . . . . 0.0 111.252 178.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-N 112.863 -1.971 . . . . 0.0 110.257 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 98.6 t . . . . . 0 N--CA 1.456 -0.143 0 CA-C-O 120.737 0.303 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.474 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.73 -37.1 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.94 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.759 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 49.1 m -66.82 -23.18 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.476 0.655 . . . . 0.0 109.653 178.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.529 ' O ' HG12 ' C' ' 92' ' ' VAL . 49.3 tp -73.96 -32.06 63.3 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.851 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.629 ' HA ' HG13 ' C' ' 92' ' ' VAL . 13.3 mmm-85 -63.27 -37.97 89.33 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.759 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.56 -36.74 79.18 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' C' ' 87' ' ' SER . 81.8 mt-30 -64.13 -33.14 75.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.128 177.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.629 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -75.11 -31.89 25.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.942 179.576 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.525 ' HA ' HE21 ' C' ' 96' ' ' GLN . 15.8 tp10 -64.64 -36.33 83.91 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.35 -59.75 4.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.522 -1.217 . . . . 0.0 111.322 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.528 HD21 HG11 ' A' ' 19' ' ' VAL . 2.5 tm? -58.93 -40.21 83.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.551 -178.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.675 ' HA ' HG23 ' C' ' 99' ' ' VAL . 20.8 pt20 -69.35 -24.3 63.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.483 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.733 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -66.13 -28.18 73.49 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.356 -1.097 . . . . 0.0 110.356 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.718 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 78.8 mm-40 -74.43 -46.27 41.06 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.414 178.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.675 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.01 -41.69 93.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.421 -0.511 . . . . 0.0 111.169 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.733 HE21 ' HA2' ' C' ' 97' ' ' GLY . 14.5 pt20 -61.87 -43.15 99.43 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.031 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.553 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.2 p-80 -78.55 -14.85 59.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.774 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.3 mt -74.21 -37.91 63.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.2 tm0? -71.08 -34.19 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.13 -51.51 69.42 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.396 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.09 -38.14 90.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.804 178.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.539 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 1.0 OUTLIER -56.32 -29.67 61.59 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 123.451 0.469 . . . . 0.0 111.016 178.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 29.6 t -48.37 -26.94 2.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.107 0.48 . . . . 0.0 111.024 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -96.98 -46.5 6.18 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.909 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 21.5 m-85 -68.48 -20.57 64.61 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.539 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 44.3 mtpt -72.11 -28.1 63.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.606 ' HA ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -101.33 31.51 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.832 0.825 . . . . 0.0 109.84 178.157 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.564 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -96.49 -42.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.956 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.562 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 20.6 tt0 -103.04 100.85 10.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.287 1.042 . . . . 0.0 111.306 178.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.606 HD21 ' HA ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.301 -1.51 0 CA-C-N 112.794 -2.003 . . . . 0.0 109.847 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.549 HG11 HG22 ' C' ' 85' ' ' VAL . 61.4 t . . . . . 0 C--O 1.233 0.211 0 CA-C-O 120.907 0.384 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -68.41 -29.29 67.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.752 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.59 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 49.2 m -70.02 -22.51 63.09 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.949 0.88 . . . . 0.0 109.391 178.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.2 tp -76.8 -21.72 54.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.513 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.655 ' O ' HG12 ' A' ' 12' ' ' VAL . 7.9 mmm180 -67.56 -33.9 75.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -71.7 -47.12 56.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 179.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -64.53 -27.75 69.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.281 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -77.64 -36.92 23.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.766 -178.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.499 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.7 mt-10 -69.99 -28.6 65.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.29 -50.93 63.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.341 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.434 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.0 tp -60.79 -39.13 87.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.124 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.499 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 16.1 pt20 -71.42 -23.45 61.86 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.325 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.6 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.34 -28.36 73.31 Favored Glycine 0 C--O 1.24 0.521 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.441 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.678 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.3 mm-40 -73.65 -42.77 60.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.98 0.419 . . . . 0.0 110.005 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.554 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 3.4 t -65.94 -42.58 92.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.159 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.6 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.6 pt20 -62.33 -41.44 98.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.539 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.449 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 6.9 p-80 -79.26 -17.38 54.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.806 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.3 mt -71.95 -47.57 51.38 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.718 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 13.2 pt20 -71.36 -22.7 61.86 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -62.21 -51.3 68.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.01 -41.64 99.63 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.548 177.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.718 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -52.03 -29.13 19.73 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.692 178.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.4 t -47.67 -33.47 6.89 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.008 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.87 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 69.6 mt-30 -86.73 -51.51 6.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.457 0.646 . . . . 0.0 110.884 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.666 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.3 m-85 -63.94 -21.31 66.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.29 -0.868 . . . . 0.0 113.167 -177.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' CE2' ' C' ' 109' ' ' TYR . 10.4 mmmm -64.63 -32.2 73.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.963 0.411 . . . . 0.0 110.51 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.87 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -108.52 35.91 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.095 0.474 . . . . 0.0 110.763 179.394 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.666 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 5.9 t -95.66 -43.59 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.575 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.444 ' HB2' HG22 ' C' ' 112' ' ' VAL . 33.7 tt0 -104.52 102.35 11.98 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 122.084 0.945 . . . . 0.0 110.551 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.413 ' CD2' ' N ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.462 0 CA-C-N 113.041 -1.89 . . . . 0.0 111.288 -179.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.533 HG11 HG22 ' A' ' 5' ' ' VAL . 60.8 t . . . . . 0 C--O 1.233 0.189 0 CA-C-O 120.778 0.323 . . . . 0.0 110.335 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.479 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.53 -29.35 68.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.788 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.613 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.6 m -69.28 -23.97 63.9 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.715 0.769 . . . . 0.0 109.461 178.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.5 tp -76.0 -21.96 56.34 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.642 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.675 ' O ' HG12 ' B' ' 52' ' ' VAL . 8.2 mmm180 -67.07 -33.96 76.64 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -71.68 -47.0 57.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.861 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -64.56 -28.11 69.41 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.062 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.675 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -76.95 -36.82 25.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.953 -178.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.519 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 47.8 mt-10 -70.57 -28.1 64.64 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 122.017 0.913 . . . . 0.0 108.551 176.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.22 -51.58 60.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.07 177.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.617 HD11 HG11 ' C' ' 99' ' ' VAL . 25.9 tp -60.19 -40.13 88.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.25 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.519 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.9 pt20 -70.68 -23.29 62.46 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.438 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.575 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.43 -29.1 72.96 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.669 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.5 mm100 -73.01 -42.44 63.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.112 0.482 . . . . 0.0 110.062 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.534 ' O ' ' HG2' ' B' ' 63' ' ' GLN . 3.5 t -66.62 -42.11 89.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.344 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.575 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.2 pt20 -62.41 -41.85 98.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.07 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.474 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.76 -17.23 56.13 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.137 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.5 mt -72.98 -46.5 51.93 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.755 ' HA ' ' HB2' ' B' ' 66' ' ' PHE . 12.7 pt20 -71.76 -22.14 61.64 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -62.42 -51.44 67.51 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.625 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.34 -41.68 98.9 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.498 177.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.755 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -51.94 -29.28 19.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.517 179.058 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 41.8 t -47.89 -34.71 9.3 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.862 0.363 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.867 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 66.9 mt-30 -85.45 -50.54 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.2 0.524 . . . . 0.0 110.841 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.689 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 15.9 m-85 -64.89 -20.62 66.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.447 ' HD2' ' CE2' ' A' ' 29' ' ' TYR . 10.2 mmmm -65.05 -32.24 73.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.117 0.484 . . . . 0.0 110.419 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.867 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -108.07 36.74 2.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.6 0.714 . . . . 0.0 110.637 179.08 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.689 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -96.51 -43.2 12.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.549 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.466 ' HB2' HG22 ' A' ' 32' ' ' VAL . 34.4 tt0 -105.11 100.83 10.41 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.031 0.92 . . . . 0.0 110.866 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.421 ' N ' ' CD2' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.302 -1.474 0 CA-C-N 113.404 -1.726 . . . . 0.0 111.29 -179.568 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.549 HG22 HG11 ' A' ' 5' ' ' VAL . 73.7 t . . . . . 0 CA--C 1.528 0.132 0 CA-C-O 120.754 0.311 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.18 -29.84 68.81 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.832 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.1 m -69.19 -22.76 63.88 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.874 0.845 . . . . 0.0 109.22 178.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.619 ' O ' HG22 ' C' ' 92' ' ' VAL . 67.1 tp -76.15 -23.02 54.78 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.713 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.51 ' HA ' ' CG2' ' C' ' 92' ' ' VAL . 8.5 mmm180 -67.51 -31.88 72.31 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.664 0.745 . . . . 0.0 109.032 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -72.51 -45.2 60.51 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.482 -0.781 . . . . 0.0 108.949 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 7.8 tt0 -65.07 -29.31 70.18 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.257 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.619 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.14 -42.18 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.91 179.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.1 mt-10 -65.0 -29.52 70.45 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.13 -52.89 52.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.408 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 16' ' ' GLN . 28.4 tp -60.22 -39.93 88.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.325 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.54 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 18.1 pt20 -71.92 -22.29 61.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.408 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.595 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -69.59 -27.83 72.95 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.655 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 11.2 mm100 -74.63 -44.62 49.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.162 0.506 . . . . 0.0 110.413 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.617 HG11 HD11 ' B' ' 55' ' ' LEU . 0.1 OUTLIER -70.74 -31.96 47.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.124 -179.077 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.595 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.8 pt20 -67.04 -42.45 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.707 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.465 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 7.6 p-80 -77.45 -17.53 58.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.234 -0.986 . . . . 0.0 110.592 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 8.4 mt -71.81 -47.06 55.9 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.706 ' HA ' ' HB2' ' C' ' 106' ' ' PHE . 14.3 pt20 -70.99 -22.75 62.14 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -61.68 -51.99 66.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.639 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.31 -41.64 98.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.706 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -51.77 -29.32 18.42 Favored 'General case' 0 C--O 1.214 -0.781 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.411 178.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 46.4 t -47.75 -34.67 8.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.831 0.348 . . . . 0.0 111.124 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.86 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 69.4 mt-30 -85.23 -50.99 6.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.51 0.672 . . . . 0.0 110.665 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.668 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 16.1 m-85 -64.5 -21.58 66.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.136 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.488 ' HD2' ' CE2' ' B' ' 69' ' ' TYR . 10.4 mmmm -65.16 -30.25 71.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.442 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.86 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -109.75 36.94 2.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.523 0.678 . . . . 0.0 110.446 179.204 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.668 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.8 t -97.22 -43.72 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.663 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.53 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 35.8 tt0 -104.73 100.66 10.3 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.252 1.025 . . . . 0.0 110.725 179.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.656 HD21 ' HA ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.304 -1.382 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.491 -179.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 74.4 t . . . . . 0 N--CA 1.454 -0.271 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -71.22 -24.81 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.122 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.656 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -73.49 -18.58 61.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.67 0.748 . . . . 0.0 109.618 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.407 HD22 ' HE ' ' B' ' 49' ' ' ARG . 60.0 tp -79.03 -18.81 52.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.729 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -70.79 -44.33 66.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.219 177.856 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.2 pt20 -70.8 -33.91 71.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.007 0.432 . . . . 0.0 109.946 178.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.9 tt0 -69.86 -31.22 68.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.457 0.646 . . . . 0.0 110.391 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.729 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.4 p -79.3 -31.47 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.154 -179.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 46.3 mt-10 -76.06 -20.47 57.72 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.06 -51.62 30.51 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.284 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.0 tp -63.16 -30.48 71.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.972 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.567 ' HA ' HD21 ' C' ' 95' ' ' LEU . 13.0 tt0 -64.4 -40.49 95.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.53 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.645 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -63.44 -27.39 70.75 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.424 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.6 mm100 -71.51 -42.34 68.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.947 0.403 . . . . 0.0 110.047 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.457 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 2.4 t -70.88 -37.61 69.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.775 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.645 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 15.3 pt20 -64.37 -40.99 96.93 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.818 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.537 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -80.12 -17.48 52.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.316 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.731 HD21 ' HG2' ' B' ' 63' ' ' GLN . 7.0 mt -71.43 -38.44 71.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' C' ' 102' ' ' LEU . 66.6 mt-30 -73.78 -27.5 61.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.7 -56.79 17.42 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.099 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.646 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.33 -43.89 97.76 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.142 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -53.42 -26.09 18.47 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.975 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -53.98 -36.89 63.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 111.446 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.614 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 24.7 pt20 -87.45 -36.48 17.67 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.103 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.741 ' OH ' ' HD2' ' B' ' 70' ' ' LYS . 26.5 m-85 -73.66 -20.41 60.57 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.439 0.638 . . . . 0.0 110.906 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.697 ' HD2' ' OH ' ' C' ' 109' ' ' TYR . 35.2 tptt -64.56 -40.32 95.35 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.172 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.629 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -95.38 31.48 1.96 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.684 0.754 . . . . 0.0 110.524 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.549 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 9.4 t -95.45 -41.27 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.062 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.556 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 16.8 tt0 -102.62 103.45 13.74 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 122.177 0.989 . . . . 0.0 110.464 178.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.408 ' N ' ' CD2' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.632 0 CA-C-N 112.942 -1.935 . . . . 0.0 110.292 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.483 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 82.2 t . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.647 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -71.29 -23.92 62.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.025 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.9 m -74.52 -18.56 60.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.6 0.714 . . . . 0.0 109.74 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.493 HD22 ' HE ' ' C' ' 89' ' ' ARG . 61.3 tp -79.36 -18.27 52.79 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.713 ' O ' HG12 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -70.75 -44.27 67.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.212 177.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.4 pt20 -70.91 -34.84 71.95 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 40.1 tt0 -68.88 -30.79 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.565 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.713 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.5 p -79.67 -32.23 14.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.233 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 46.1 mt-10 -75.54 -20.17 58.86 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.13 -51.88 27.96 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.156 177.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.582 HD21 ' HB3' ' C' ' 95' ' ' LEU . 23.0 tp -63.09 -30.29 71.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.989 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -64.0 -39.83 94.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.572 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.637 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -64.39 -26.89 71.0 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.733 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.664 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.2 mm100 -72.03 -42.7 66.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.062 0.458 . . . . 0.0 110.0 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.4 t -69.97 -37.96 74.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.782 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.637 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -64.53 -41.76 96.17 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.013 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.53 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.9 p-80 -78.9 -17.32 55.74 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.328 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.723 HD21 ' HG2' ' C' ' 103' ' ' GLN . 7.0 mt -71.88 -38.43 70.02 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' A' ' 22' ' ' LEU . 63.9 mt-30 -73.98 -26.51 60.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -61.07 -55.96 26.5 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.09 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.82 -44.98 94.72 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.042 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -52.46 -25.94 11.46 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.893 179.211 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 28.2 t -54.61 -35.62 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.748 0.249 . . . . 0.0 111.44 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' B' ' 65' ' ' ALA . 24.0 pt20 -88.74 -36.4 16.15 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.039 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.742 ' OH ' ' HD2' ' C' ' 110' ' ' LYS . 27.0 m-85 -73.79 -19.96 60.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.304 0.573 . . . . 0.0 110.761 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.741 ' HD2' ' OH ' ' A' ' 29' ' ' TYR . 32.8 tptt -64.55 -41.23 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.933 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.608 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -94.53 31.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.433 0.635 . . . . 0.0 110.775 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 9.3 t -95.17 -41.68 12.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.931 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.629 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 15.1 tt0 -102.46 103.41 13.79 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 122.24 1.019 . . . . 0.0 110.658 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.421 ' N ' ' CD2' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.615 0 CA-C-N 112.811 -1.995 . . . . 0.0 110.114 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.493 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 84.9 t . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.62 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -71.84 -24.01 61.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.265 178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 71.1 m -74.9 -18.57 60.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.743 0.783 . . . . 0.0 109.25 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.727 ' O ' HG22 ' C' ' 92' ' ' VAL . 57.0 tp -77.63 -19.3 55.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.62 ' HB2' ' O ' ' C' ' 86' ' ' ALA . 0.2 OUTLIER -71.32 -42.71 68.24 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.649 178.272 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 pt20 -70.95 -33.52 70.55 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 38.8 tt0 -68.82 -33.49 73.92 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.238 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.727 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.82 -38.52 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.913 178.243 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 42.0 mt-10 -68.49 -21.56 64.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.96 -52.54 23.55 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.208 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.582 ' HB3' HD21 ' B' ' 55' ' ' LEU . 0.3 OUTLIER -60.66 -33.52 72.94 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.944 178.128 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -62.66 -40.38 96.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.899 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.543 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -64.87 -27.19 71.81 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.481 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.2 mm100 -71.58 -42.77 67.38 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 178.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.476 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 2.5 t -70.73 -37.17 67.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.543 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.3 pt20 -65.25 -40.74 94.39 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.616 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.568 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.6 p-80 -80.42 -17.5 51.6 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.296 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.689 HD21 ' HG2' ' A' ' 23' ' ' GLN . 7.2 mt -71.13 -38.53 72.28 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.723 ' HG2' HD21 ' B' ' 62' ' ' LEU . 63.2 mt-30 -73.87 -27.21 60.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.51 -56.96 15.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.299 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.638 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.16 -44.45 96.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.155 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -52.92 -26.88 16.36 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.022 179.461 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 34.4 t -53.14 -37.84 62.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.684 0.278 . . . . 0.0 111.194 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' C' ' 105' ' ' ALA . 25.1 pt20 -87.0 -35.9 18.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.368 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.697 ' OH ' ' HD2' ' A' ' 30' ' ' LYS . 28.7 m-85 -74.21 -19.93 60.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.361 0.6 . . . . 0.0 110.85 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.742 ' HD2' ' OH ' ' B' ' 69' ' ' TYR . 32.0 tptt -64.67 -40.8 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.994 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.608 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -95.06 31.71 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.481 0.658 . . . . 0.0 110.753 179.08 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.535 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 10.9 t -95.97 -41.38 11.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.954 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.608 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 15.7 tt0 -102.52 101.69 11.89 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-O 122.459 1.124 . . . . 0.0 111.221 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.551 ' HG ' ' C ' ' C' ' 113' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--N 1.3 -1.559 0 CA-C-N 112.651 -2.068 . . . . 0.0 109.723 -179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 HG11 ' B' ' 45' ' ' VAL . 90.1 t . . . . . 0 C--O 1.234 0.238 0 CA-C-O 120.737 0.303 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.636 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.0 -24.84 64.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.289 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 70.7 m -69.66 -26.18 64.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.0 tp -73.59 -23.55 59.95 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.053 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 48.4 mmm-85 -63.45 -23.68 67.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.253 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.4 mt-30 -76.34 -43.21 42.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.522 -179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 52.0 tt0 -70.03 -29.29 66.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.454 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.9 t -74.6 -36.37 40.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.077 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -66.36 -32.12 73.31 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -64.98 -56.73 11.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.283 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 mp -57.7 -39.08 76.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.034 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -70.67 -31.33 68.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.1 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -72.72 -31.14 62.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 119.933 -1.127 . . . . 0.0 111.494 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 14' ' ' ALA . 77.6 mm-40 -76.37 -35.52 58.63 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 120.806 0.336 . . . . 0.0 110.575 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.7 t -77.16 -32.03 18.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.729 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.589 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -67.98 -40.12 83.17 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.487 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.526 ' CE1' HD12 ' A' ' 22' ' ' LEU . 6.8 p-80 -80.44 -25.6 38.86 Favored 'General case' 0 N--CA 1.46 0.049 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.928 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.756 HD11 ' HG3' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -72.87 -39.73 66.22 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.863 178.475 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.694 ' HG3' HD21 ' C' ' 102' ' ' LEU . 26.6 tt0 -70.71 -36.86 73.44 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.87 -56.61 19.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.967 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.35 -48.21 82.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.77 179.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.775 ' HD2' HD13 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.54 -24.84 22.53 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.064 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.2 t -49.61 -32.2 12.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.64 0.257 . . . . 0.0 111.04 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.429 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 12.9 mm100 -96.3 -45.63 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.081 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.8 m-85 -66.47 -20.08 65.95 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -73.24 -4.4 32.82 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.908 0.385 . . . . 0.0 110.868 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.609 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -127.76 36.06 4.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.983 0.897 . . . . 0.0 108.73 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.569 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 12.8 t -100.58 -34.63 4.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.127 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -85.62 81.64 8.57 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 122.969 1.366 . . . . 0.0 111.417 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.609 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.292 -1.922 0 CA-C-N 111.95 -2.387 . . . . 0.0 109.539 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.416 HG11 HG22 ' A' ' 5' ' ' VAL . 97.7 t . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.924 0.393 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -68.84 -25.58 64.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.244 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 73.4 m -69.01 -26.22 64.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 55.7 tp -73.1 -23.79 60.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.066 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.654 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 47.8 mmm-85 -63.81 -21.85 66.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.973 0.415 . . . . 0.0 110.215 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.8 mt-30 -77.94 -43.68 29.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.287 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 52.0 tt0 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.622 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 26.7 t -74.85 -37.79 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 88.8 tt0 -65.37 -31.79 73.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' B' ' 58' ' ' GLN . . . -65.35 -56.58 11.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.442 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 59' ' ' VAL . 4.7 mp -57.68 -39.23 76.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.93 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.459 ' HB3' HD21 ' A' ' 15' ' ' LEU . 19.8 pt20 -70.35 -31.95 69.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.087 -179.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.582 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -71.98 -30.89 64.98 Favored Glycine 0 C--O 1.238 0.396 0 C-N-CA 120.08 -1.057 . . . . 0.0 111.373 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' B' ' 54' ' ' ALA . 77.0 mm-40 -76.58 -36.49 57.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.795 0.331 . . . . 0.0 110.528 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.9 t -76.28 -31.29 20.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 122.256 -0.278 . . . . 0.0 110.711 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -69.02 -40.51 78.62 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.279 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.548 ' CE1' HD12 ' B' ' 62' ' ' LEU . 6.8 p-80 -80.18 -24.97 39.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 119.856 -0.738 . . . . 0.0 111.061 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.673 HD11 ' HG3' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -74.03 -39.5 63.53 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.584 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.756 ' HG3' HD11 ' A' ' 22' ' ' LEU . 23.3 tt0 -69.93 -38.72 76.29 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.57 30.6 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.122 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.722 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.51 -48.03 82.9 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.797 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.692 ' HD2' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.65 -24.39 21.45 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.286 -179.615 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -49.96 -31.88 13.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.772 0.32 . . . . 0.0 110.999 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' B' ' 71' ' ' LYS . 12.8 mm100 -96.83 -44.86 6.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 111.096 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.722 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 14.4 m-85 -67.12 -19.69 65.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -73.57 -4.07 31.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.023 0.439 . . . . 0.0 110.786 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.619 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -127.98 35.89 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.782 0.801 . . . . 0.0 109.012 177.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.56 HG23 ' HA ' ' B' ' 69' ' ' TYR . 11.8 t -100.33 -34.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.101 -179.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -84.79 80.89 9.11 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 123.11 1.434 . . . . 0.0 111.402 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.619 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.292 -1.893 0 CA-C-N 111.978 -2.374 . . . . 0.0 109.926 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 92.1 t . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 120.84 0.352 . . . . 0.0 110.7 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.657 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.68 -25.02 64.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.283 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 73.4 m -69.67 -25.75 64.05 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 54.9 tp -73.77 -23.6 59.74 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.984 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.657 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 48.3 mmm-85 -64.21 -21.7 66.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.194 178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 3.8 mt-30 -78.45 -43.47 27.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.027 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 51.8 tt0 -69.42 -29.91 67.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.728 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 25.3 t -74.71 -36.14 39.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.819 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.03 -31.27 72.06 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' C' ' 98' ' ' GLN . . . -66.02 -56.42 11.69 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.249 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.604 ' O ' HG23 ' C' ' 99' ' ' VAL . 7.3 mt -57.05 -40.33 76.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.703 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' B' ' 55' ' ' LEU . 20.0 pt20 -70.06 -32.32 70.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.397 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.592 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -71.62 -31.66 65.09 Favored Glycine 0 C--O 1.239 0.451 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.268 178.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' C' ' 94' ' ' ALA . 77.0 mm-40 -76.2 -34.91 59.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.674 0.273 . . . . 0.0 110.706 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.604 HG23 ' O ' ' C' ' 95' ' ' LEU . 60.1 t -77.52 -31.46 17.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.697 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -68.71 -38.72 80.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.324 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.59 ' CE1' HD23 ' C' ' 102' ' ' LEU . 6.3 p-80 -81.77 -26.41 34.47 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.604 -0.839 . . . . 0.0 111.097 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.775 HD13 ' HD2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.54 -47.09 70.88 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.673 ' HG3' HD11 ' B' ' 62' ' ' LEU . 24.2 tt0 -67.51 -38.38 84.21 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.31 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.64 -55.96 25.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.002 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.729 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.01 -47.78 84.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.993 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.646 ' HD2' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -54.93 -24.01 21.66 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.968 -179.432 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.2 t -50.44 -31.04 14.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.638 0.256 . . . . 0.0 110.841 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' C' ' 111' ' ' LYS . 12.8 mm100 -97.58 -46.0 6.19 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.002 178.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.729 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 15.5 m-85 -65.98 -19.98 66.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -72.75 -5.15 35.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.024 0.44 . . . . 0.0 110.856 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.542 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -126.8 35.39 4.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.97 0.891 . . . . 0.0 108.908 177.636 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.594 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -99.4 -34.81 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.236 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -85.19 81.43 8.83 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 123.081 1.42 . . . . 0.0 111.427 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.542 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.29 -2.005 0 CA-C-N 112.029 -2.35 . . . . 0.0 109.62 179.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.677 HG22 HG11 ' B' ' 45' ' ' VAL . 45.3 t . . . . . 0 N--CA 1.454 -0.25 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.663 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.8 -27.0 62.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.393 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 66.2 m -71.0 -17.49 62.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.813 0.816 . . . . 0.0 109.247 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.6 tp -78.21 -21.83 49.46 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.485 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.663 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -69.62 -16.65 63.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.46 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.472 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 9.0 mm-40 -77.87 -40.02 41.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.774 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.492 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 3.7 tp-100 -73.24 -25.18 60.62 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.014 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.87 -45.92 54.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.8 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -67.53 -26.91 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -63.07 -54.29 40.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.36 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' B' ' 56' ' ' GLN . 13.1 tp -60.86 -32.96 72.37 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.647 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.606 ' HA ' HD11 ' C' ' 95' ' ' LEU . 10.3 tt0 -63.6 -36.42 83.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.33 178.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.21 -31.43 76.94 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.803 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.638 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 71.0 mt-30 -73.98 -47.54 36.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.093 0.473 . . . . 0.0 111.213 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.6 p -66.48 -36.16 76.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -65.78 -44.58 85.35 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.869 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.508 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -75.36 -13.76 60.43 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.368 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -73.58 -34.69 65.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.29 -35.41 77.8 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.41 -50.69 72.18 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.531 178.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.79 -42.46 99.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.056 178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.54 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 6.6 m-85 -56.27 -27.28 54.71 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.71 179.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t -54.63 -27.13 37.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.164 0.507 . . . . 0.0 110.606 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 87.4 mm-40 -94.68 -37.6 11.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.607 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 37.7 m-85 -77.98 -18.81 55.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 0.0 111.481 -179.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 4.2 tmtt? -58.04 -49.88 75.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.42 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.729 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER -88.77 39.46 0.92 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.206 1.003 . . . . 0.0 110.501 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.57 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 51.4 t -125.1 -10.55 5.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.673 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.582 ' HA ' HG21 ' C' ' 112' ' ' VAL . 10.8 pt-20 -75.45 -35.19 60.95 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.469 0.476 0 CA-C-O 121.862 0.839 . . . . 0.0 112.732 -177.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.677 HG11 HG22 ' A' ' 5' ' ' VAL . 41.8 t . . . . . 0 N--CA 1.455 -0.223 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.659 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.27 -25.84 61.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.34 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 68.2 m -71.74 -17.56 62.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.933 0.873 . . . . 0.0 109.429 178.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 61.4 tp -78.02 -22.68 48.87 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.269 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 0.3 OUTLIER -68.85 -15.57 63.53 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.444 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -79.57 -39.34 31.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.767 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 3.8 tp-100 -74.16 -25.04 59.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.833 0.825 . . . . 0.0 109.037 178.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.89 -45.66 54.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.7 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -68.04 -26.58 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -63.89 -52.97 57.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' C' ' 96' ' ' GLN . 13.3 tp -62.11 -32.36 72.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.632 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.576 ' HA ' HD11 ' A' ' 15' ' ' LEU . 9.0 tt0 -64.31 -35.73 81.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.219 178.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.422 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.71 -31.28 77.45 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.84 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.618 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.3 mt-30 -73.88 -47.77 35.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.035 0.445 . . . . 0.0 110.982 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.488 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.5 p -66.27 -36.23 76.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.6 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 17.4 pt20 -65.64 -44.47 86.3 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.664 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.514 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 7.5 p-80 -75.59 -13.46 60.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.651 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.3 mt -74.22 -35.09 63.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -67.79 -35.6 78.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.06 -51.4 69.42 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.508 -1.223 . . . . 0.0 109.378 177.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.724 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.63 -43.41 97.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.884 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.547 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 7.4 m-85 -55.53 -28.24 53.6 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.679 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.7 t -53.66 -27.41 27.32 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.249 0.547 . . . . 0.0 110.775 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.707 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 89.6 mm-40 -94.64 -38.65 10.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.496 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.724 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 36.0 m-85 -77.04 -18.58 58.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.919 0.39 . . . . 0.0 111.675 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.547 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 4.5 tmtt? -58.77 -49.08 78.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.363 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER -89.25 39.65 0.95 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.989 0.899 . . . . 0.0 110.363 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.58 HG21 ' HA ' ' C' ' 113' ' ' GLU . 55.6 t -125.66 -9.87 5.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.734 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.611 ' HG3' HD13 ' B' ' 74' ' ' LEU . 12.1 pt-20 -76.27 -34.24 59.12 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.875 ' H ' HD22 ' B' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 121.909 0.862 . . . . 0.0 112.972 -177.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.641 HG22 HG11 ' A' ' 5' ' ' VAL . 40.2 t . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.15 -26.27 62.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.464 . . . . 0.0 110.414 178.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 70.6 m -70.7 -17.65 62.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.917 0.865 . . . . 0.0 109.415 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.673 ' O ' HG13 ' C' ' 92' ' ' VAL . 53.1 tp -79.23 -22.99 44.03 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.654 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -69.79 -12.56 61.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.459 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.433 ' H ' ' HG2' ' C' ' 90' ' ' GLN . 0.4 OUTLIER -81.62 -37.44 27.57 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.742 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.427 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 3.3 tp-100 -75.01 -27.11 59.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.906 177.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.673 HG13 ' O ' ' C' ' 88' ' ' LEU . 1.5 m -75.76 -38.08 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.561 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -68.38 -27.87 66.62 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -63.99 -52.41 59.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.15 178.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.606 HD11 ' HA ' ' A' ' 16' ' ' GLN . 13.1 tp -61.47 -33.46 73.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.738 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.608 ' HA ' HD11 ' B' ' 55' ' ' LEU . 10.6 tt0 -63.54 -35.72 81.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.391 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.5 -31.64 78.31 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.755 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.629 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 64.0 mt-30 -74.05 -47.37 37.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.097 0.475 . . . . 0.0 111.137 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.516 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -66.53 -35.58 75.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.811 -179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 16.4 pt20 -66.35 -44.29 83.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.951 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.7 p-80 -75.88 -13.46 60.27 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.629 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 6.2 mt -72.93 -35.84 67.11 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -67.3 -36.03 80.68 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 176.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -56.46 -51.38 68.64 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.621 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.72 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.23 -42.81 99.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.291 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.577 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 15.6 m-85 -56.05 -27.88 55.21 Favored 'General case' 0 C--O 1.214 -0.816 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.563 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 24.1 t -52.99 -26.45 15.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.151 0.5 . . . . 0.0 110.694 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.75 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 91.2 mm-40 -96.49 -37.75 10.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.72 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 37.0 m-85 -78.32 -18.95 54.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.997 0.427 . . . . 0.0 111.494 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' C' ' 106' ' ' PHE . 3.7 tmtt? -58.79 -47.39 84.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.598 -179.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.75 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.2 OUTLIER -90.47 38.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.095 0.95 . . . . 0.0 110.138 178.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.582 HG21 ' HA ' ' A' ' 33' ' ' GLU . 53.6 t -124.48 -10.37 6.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.813 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' B' ' 72' ' ' VAL . 10.4 pt-20 -75.37 -36.4 60.95 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.886 HD22 ' H ' ' C' ' 114' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.47 0.554 0 CA-C-O 121.979 0.895 . . . . 0.0 113.023 -177.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 90.2 t . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.958 0.409 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.971 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.99 -25.77 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.832 179.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 67.7 m -71.69 -22.31 61.67 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.463 ' HA ' ' HG2' ' A' ' 11' ' ' GLN . 62.1 tp -78.92 -26.3 43.69 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.799 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.971 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -64.23 -49.0 73.68 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.491 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.4 pt20 -61.99 -48.5 80.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.108 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 8' ' ' LEU . 15.8 pt20 -68.41 -21.24 64.69 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.198 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.36 -34.92 21.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.771 ' HA ' HE21 ' A' ' 16' ' ' GLN . 48.9 mt-10 -70.1 -28.03 65.08 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.91 -58.57 5.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.177 178.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -62.01 -36.28 81.07 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.703 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.771 HE21 ' HA ' ' A' ' 13' ' ' GLU . 9.4 pt20 -71.06 -22.3 62.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.682 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -69.05 -32.8 73.35 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.056 -1.068 . . . . 0.0 110.655 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 54.1 mt-30 -72.65 -49.85 29.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.47 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.708 ' HB ' HG21 ' B' ' 59' ' ' VAL . 2.9 p -67.42 -28.71 43.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.833 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.682 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 13.2 pt20 -67.38 -43.93 80.2 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -77.73 -18.34 56.64 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.139 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 44.9 mt -72.24 -40.27 67.85 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.592 ' HB2' HD11 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -70.79 -36.85 73.22 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -54.87 41.8 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.098 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.58 -44.39 97.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.402 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.688 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.93 -26.53 36.75 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.422 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -50.15 -24.79 2.98 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.88 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.717 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 99.0 mm-40 -102.27 -41.09 6.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.375 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.5 m-85 -73.28 -19.59 61.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -178.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 26' ' ' PHE . 43.1 mtmt -69.95 -8.86 52.33 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.855 0.359 . . . . 0.0 110.726 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.717 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.81 37.05 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.74 0.781 . . . . 0.0 109.78 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.621 HG23 ' HA ' ' A' ' 29' ' ' TYR . 8.2 t -100.95 -43.27 10.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.134 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.492 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 31.9 tt0 -87.4 88.92 7.81 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 122.613 1.196 . . . . 0.0 111.259 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.587 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.034 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.552 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 96.6 t . . . . . 0 N--CA 1.455 -0.178 0 CA-C-O 120.665 0.269 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.995 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.36 -25.6 61.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.869 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.682 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 66.4 m -71.86 -21.92 61.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.457 ' HA ' ' HG2' ' B' ' 51' ' ' GLN . 62.3 tp -79.29 -26.46 42.3 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.434 177.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.995 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -63.34 -49.46 73.84 Favored 'General case' 0 N--CA 1.461 0.106 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.25 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.5 pt20 -62.21 -48.25 80.82 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.295 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 48' ' ' LEU . 15.9 pt20 -68.21 -21.64 64.84 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 120.145 -0.622 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -34.79 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.807 ' HA ' HE21 ' B' ' 56' ' ' GLN . 48.4 mt-10 -69.54 -30.13 67.88 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -62.99 -59.12 5.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.521 178.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -61.6 -35.47 77.96 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.807 HE21 ' HA ' ' B' ' 53' ' ' GLU . 9.2 pt20 -71.57 -22.21 61.77 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.769 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.696 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -68.9 -33.97 76.14 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.771 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 55.5 mt-30 -71.48 -48.95 45.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.069 0.461 . . . . 0.0 110.575 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.711 ' HB ' HG11 ' C' ' 99' ' ' VAL . 2.9 p -68.77 -28.05 38.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.814 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 13.3 pt20 -67.7 -43.26 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.439 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -78.31 -19.11 54.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.991 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 50.7 mt -71.55 -40.73 69.84 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.597 ' HB2' HD11 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -70.29 -37.34 74.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.45 -55.33 35.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.149 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.691 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.18 -44.75 96.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.377 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.696 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.84 -26.5 35.63 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.336 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -48.9 -27.49 3.13 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.984 0.421 . . . . 0.0 110.595 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.758 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 96.7 mm-40 -99.92 -41.14 7.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.725 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.691 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 38.6 m-85 -72.85 -19.83 61.23 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 66' ' ' PHE . 41.5 mtmt -69.5 -8.34 46.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.67 0.271 . . . . 0.0 110.745 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.758 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -129.44 38.12 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.133 0.968 . . . . 0.0 109.782 178.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.633 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 10.4 t -101.61 -43.57 10.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.809 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.531 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 31.4 tt0 -87.68 89.38 7.97 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 122.742 1.258 . . . . 0.0 111.314 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.585 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--N 1.29 -2.003 0 CA-C-N 112.313 -2.221 . . . . 0.0 109.4 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 84.7 t . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 120.939 0.4 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 1.04 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.62 -25.24 61.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.845 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 64.2 m -72.48 -21.21 61.25 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.48 ' HA ' ' HG2' ' C' ' 91' ' ' GLN . 63.4 tp -79.9 -26.3 40.27 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.626 177.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 1.04 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.7 OUTLIER -64.23 -48.14 76.95 Favored 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.5 pt20 -63.5 -47.7 80.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.931 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' C' ' 88' ' ' LEU . 16.1 pt20 -69.21 -20.51 63.98 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 119.999 -0.68 . . . . 0.0 111.0 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.05 -34.68 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.749 ' HA ' HE21 ' C' ' 96' ' ' GLN . 47.4 mt-10 -69.86 -30.32 67.76 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -61.58 -59.8 4.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.088 -1.415 . . . . 0.0 110.092 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.69 -38.81 89.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.455 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.749 HE21 ' HA ' ' C' ' 93' ' ' GLU . 10.0 pt20 -66.64 -22.1 66.11 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.564 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -68.6 -32.95 75.38 Favored Glycine 0 C--O 1.24 0.473 0 C-N-CA 120.084 -1.055 . . . . 0.0 110.753 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.793 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 52.7 mt-30 -72.04 -46.97 54.99 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.711 HG11 ' HB ' ' B' ' 59' ' ' VAL . 0.2 OUTLIER -64.77 -37.55 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.125 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 14.6 pt20 -62.34 -42.14 99.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -177.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -80.48 -17.83 50.45 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.44 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 48.4 mt -73.53 -40.49 63.96 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.557 ' HB2' HD11 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.1 -37.57 72.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.661 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.88 28.53 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.043 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.85 -44.08 97.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.46 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.693 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -55.0 -25.23 28.53 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.596 -179.82 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 32.0 t -51.33 -26.23 7.25 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.09 0.471 . . . . 0.0 110.887 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.724 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 99.2 mm-40 -100.72 -40.76 7.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.321 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.756 ' HA ' HG13 ' C' ' 112' ' ' VAL . 39.5 m-85 -73.1 -19.21 61.2 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' C' ' 106' ' ' PHE . 43.9 mtmt -69.53 -8.88 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.652 0.263 . . . . 0.0 110.435 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.724 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -127.85 34.41 4.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.599 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.756 HG13 ' HA ' ' C' ' 109' ' ' TYR . 0.8 OUTLIER -103.44 -35.03 3.6 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.399 177.759 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 31.3 tt0 -85.85 87.24 7.38 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.849 1.309 . . . . 0.0 110.454 178.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.601 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.29 -2.0 0 CA-C-N 112.14 -2.3 . . . . 0.0 109.313 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.437 HG22 HG11 ' B' ' 45' ' ' VAL . 91.1 t . . . . . 0 CA--C 1.531 0.222 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.58 -29.52 68.9 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.681 179.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.0 m -67.03 -23.41 65.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.394 0.616 . . . . 0.0 109.736 178.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.576 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 68.0 tp -79.39 -24.66 42.45 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.449 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 12.7 mmm-85 -71.83 -33.69 68.7 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -75.19 -42.61 55.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.379 179.093 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 7' ' ' SER . 97.3 mm-40 -65.2 -32.8 74.66 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.401 0.619 . . . . 0.0 110.308 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -77.91 -26.94 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.172 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -69.55 -30.62 68.47 Favored 'General case' 0 C--O 1.227 -0.091 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.14 -51.41 46.39 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.69 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 52.1 mt -58.7 -31.92 68.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.073 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.444 ' HA ' HG12 ' A' ' 19' ' ' VAL . 21.1 tt0 -70.6 -48.26 56.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.711 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -59.61 -29.69 67.36 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.602 -0.809 . . . . 0.0 111.435 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.35 -50.51 21.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.045 0.45 . . . . 0.0 111.065 179.579 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.444 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.5 p -67.62 -31.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.5 pt20 -70.45 -41.53 72.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.811 -0.177 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -78.07 -18.31 55.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.239 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 15.3 mt -71.19 -40.29 71.31 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.465 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.4 OUTLIER -71.14 -34.01 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.68 31.44 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.296 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.669 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.96 -39.08 93.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.479 178.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -55.73 -26.49 45.71 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.516 179.459 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.9 t -50.2 -32.54 16.69 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.225 0.536 . . . . 0.0 110.371 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.781 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 16.2 mm100 -87.88 -53.69 4.62 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.342 177.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 14.1 m-85 -60.7 -20.59 61.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 14.7 mttp -66.11 -35.35 80.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.497 0.189 . . . . 0.0 110.822 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -100.35 33.17 2.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.232 0.539 . . . . 0.0 110.825 179.591 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.663 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 67.5 t -97.24 -43.97 12.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.708 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' C' ' 112' ' ' VAL . 7.0 tt0 -119.74 105.48 11.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.315 1.055 . . . . 0.0 109.583 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.561 HD13 ' HA ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.67 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.007 -178.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.437 HG11 HG22 ' A' ' 5' ' ' VAL . 85.6 t . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.666 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.87 -29.15 68.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.811 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.678 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 53.7 m -67.29 -23.33 65.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.42 0.628 . . . . 0.0 109.847 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.569 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 66.8 tp -79.57 -24.6 41.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.295 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.666 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 13.2 mmm-85 -71.62 -33.44 68.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.678 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -75.8 -41.81 51.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.425 179.221 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 47' ' ' SER . 97.2 mm-40 -65.57 -33.42 75.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.563 0.697 . . . . 0.0 110.083 178.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.569 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 0.3 OUTLIER -76.99 -27.07 16.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.261 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -69.58 -31.35 69.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -67.6 -50.72 56.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.077 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 52.6 mt -59.04 -32.47 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.967 179.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.43 ' HA ' HG12 ' B' ' 59' ' ' VAL . 22.6 tt0 -70.26 -48.0 58.78 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.715 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.97 -29.13 67.29 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.515 -0.85 . . . . 0.0 111.653 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.75 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -74.03 -50.05 21.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.936 0.398 . . . . 0.0 110.96 179.453 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' B' ' 56' ' ' GLN . 14.8 p -67.84 -31.8 53.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 122.131 -0.356 . . . . 0.0 111.902 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.6 pt20 -70.23 -41.74 73.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.779 -0.192 . . . . 0.0 110.836 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -78.17 -18.38 55.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.762 -0.775 . . . . 0.0 110.463 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 16.5 mt -71.41 -39.16 71.29 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.455 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.85 -33.72 68.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.448 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.51 -55.19 38.03 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.3 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.654 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.41 -39.21 93.88 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.354 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.521 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -55.95 -26.13 46.6 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.457 179.329 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -50.74 -31.78 17.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.201 0.524 . . . . 0.0 110.226 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.754 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 15.9 mm100 -88.09 -53.51 4.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.413 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.654 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 13.2 m-85 -60.97 -20.95 63.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 14.7 mttp -65.66 -36.08 82.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.877 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.754 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -99.6 33.11 2.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.481 0.658 . . . . 0.0 110.989 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.648 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 62.5 t -96.82 -43.55 12.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.789 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -120.29 105.61 11.09 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.301 1.048 . . . . 0.0 109.733 176.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.565 HD13 ' HA ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.298 -1.644 0 CA-C-N 112.771 -2.013 . . . . 0.0 108.686 -178.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.411 HG11 HG22 ' B' ' 45' ' ' VAL . 88.0 t . . . . . 0 CA--C 1.528 0.118 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.77 -29.42 68.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.924 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 54.4 m -67.05 -23.78 65.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.471 0.653 . . . . 0.0 109.524 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.631 ' O ' HG22 ' C' ' 92' ' ' VAL . 66.9 tp -78.15 -25.6 47.38 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.78 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.599 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 10.2 mmm-85 -72.5 -31.14 65.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -76.26 -40.81 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.474 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 87' ' ' SER . 97.4 mm-40 -65.82 -34.45 78.18 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.631 HG22 ' O ' ' C' ' 88' ' ' LEU . 1.1 m -74.59 -28.99 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.468 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -65.94 -32.44 73.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.53 -52.53 37.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.912 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.409 HD21 ' HB2' ' A' ' 16' ' ' GLN . 0.3 OUTLIER -56.75 -34.44 67.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.119 178.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.443 ' HA ' HG12 ' C' ' 99' ' ' VAL . 22.0 tt0 -69.68 -48.07 60.99 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.655 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -59.39 -29.62 66.6 Favored Glycine 0 C--O 1.237 0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.545 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.739 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -74.17 -50.44 19.29 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.406 -0.397 . . . . 0.0 111.047 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.9 p -67.5 -31.88 54.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 17.0 pt20 -70.02 -42.3 73.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.942 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -77.58 -18.1 57.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.589 -0.845 . . . . 0.0 110.253 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.6 mt -71.26 -39.57 71.51 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.586 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.7 OUTLIER -71.1 -34.99 71.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.27 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.89 -56.07 26.36 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.425 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.658 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.7 -38.28 89.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.584 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.514 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.89 -26.12 58.26 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.439 179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.1 t -50.37 -32.66 18.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.095 0.474 . . . . 0.0 109.951 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.773 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 15.9 mm100 -87.68 -53.02 5.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.645 177.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.665 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 13.2 m-85 -61.6 -20.54 63.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 14.5 mttp -65.91 -36.06 82.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.635 0.255 . . . . 0.0 110.686 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -99.3 33.03 2.54 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.157 0.503 . . . . 0.0 111.055 179.241 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.665 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 60.0 t -96.94 -43.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.852 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.401 ' HB2' ' CG2' ' B' ' 72' ' ' VAL . 6.4 tt0 -120.47 105.66 11.08 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 122.45 1.119 . . . . 0.0 109.741 176.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER . . . . . 0 C--N 1.295 -1.763 0 CA-C-N 112.783 -2.008 . . . . 0.0 108.84 -178.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 121.046 0.45 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.738 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.12 -24.17 65.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.282 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -68.04 -29.01 67.89 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-O 121.721 0.772 . . . . 0.0 109.125 178.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 51.1 tp -75.75 -22.4 56.54 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.152 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.738 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 41.3 mmm-85 -65.77 -37.58 86.72 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.03 -43.79 81.9 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.656 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.9 tt0 -63.6 -31.3 72.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.89 0.852 . . . . 0.0 109.61 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.55 -28.91 29.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.769 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.818 ' HA ' HE21 ' A' ' 16' ' ' GLN . 58.0 mt-10 -68.15 -29.47 68.36 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.01 -55.4 12.76 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.314 177.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.439 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.9 mm? -59.8 -36.84 77.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.827 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.818 HE21 ' HA ' ' A' ' 13' ' ' GLU . 24.7 pt20 -75.13 -26.83 59.48 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.181 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.616 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -68.63 -33.49 76.4 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 177.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 93.1 mm-40 -70.76 -48.62 53.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.837 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 16' ' ' GLN . 6.1 p -67.43 -33.96 65.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.616 HE21 ' HA2' ' A' ' 17' ' ' GLY . 15.9 pt20 -66.6 -45.7 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.941 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.498 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.9 p-80 -74.57 -17.52 60.71 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 119.736 -0.786 . . . . 0.0 110.433 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.8 mt -72.05 -37.8 69.6 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.706 ' HG2' HD21 ' C' ' 102' ' ' LEU . 74.1 mt-30 -70.88 -30.38 66.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.43 -59.19 5.52 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.465 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.503 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.43 -39.68 91.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.117 178.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -56.27 -26.61 52.41 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -59.22 -28.18 66.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.822 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.644 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 14.5 mm100 -89.59 -33.87 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.561 ' CE1' ' HB3' ' B' ' 73' ' ' GLU . 21.6 m-85 -78.45 -18.4 54.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.581 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.491 ' HA ' ' OH ' ' C' ' 109' ' ' TYR . 8.5 tmtt? -55.47 -46.73 76.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.303 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.756 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -91.13 37.29 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.408 0.623 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.691 HG11 HG12 ' B' ' 72' ' ' VAL . 96.2 t -121.19 3.85 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.97 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.56 ' HB3' ' CE1' ' C' ' 109' ' ' TYR . 9.5 pt-20 -93.85 -27.63 16.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 O-C-N 121.681 -0.637 . . . . 0.0 112.288 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.633 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 121.479 0.657 . . . . 0.0 110.499 179.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.875 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.34 -23.65 65.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.157 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.648 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 68.1 m -68.38 -28.41 67.08 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.856 0.836 . . . . 0.0 109.35 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.61 -22.54 54.04 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.885 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 41.7 mmm-85 -65.25 -38.59 90.8 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -66.58 -43.8 83.95 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.048 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 38.6 tt0 -62.96 -31.87 73.07 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.983 0.897 . . . . 0.0 109.377 178.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -29.58 32.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.841 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . 0.763 ' HA ' HE21 ' B' ' 56' ' ' GLN . 54.9 mt-10 -67.45 -28.37 67.82 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.01 -55.69 10.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.18 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.462 ' HA ' HD13 ' B' ' 55' ' ' LEU . 3.0 mm? -59.27 -37.46 77.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.739 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.763 HE21 ' HA ' ' B' ' 53' ' ' GLU . 24.3 pt20 -74.43 -27.36 60.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.487 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.619 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -68.7 -32.78 74.74 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.748 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 94.4 mm-40 -70.65 -49.2 49.89 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 121.017 0.437 . . . . 0.0 111.011 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.568 HG12 ' HA ' ' B' ' 56' ' ' GLN . 5.7 p -67.2 -33.95 66.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.619 HE21 ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -66.41 -45.6 79.38 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.119 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.505 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 7.3 p-80 -74.62 -17.76 60.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.451 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.8 mt -71.93 -38.46 69.85 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 73.7 mt-30 -70.23 -30.95 68.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.21 -58.13 9.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.722 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.526 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.05 -40.0 94.28 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.082 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.55 -25.9 53.38 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.083 -179.849 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -59.71 -28.92 67.74 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.639 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . 0.686 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 14.5 mm100 -89.07 -33.35 17.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.753 0.311 . . . . 0.0 111.007 179.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.526 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.8 m-85 -78.84 -17.48 55.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.694 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.502 ' HA ' ' OH ' ' A' ' 29' ' ' TYR . 8.7 tmtt? -56.31 -47.32 78.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.377 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.739 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.5 OUTLIER -90.09 37.23 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.184 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.691 HG12 HG11 ' A' ' 32' ' ' VAL . 99.4 t -120.84 2.63 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.074 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.561 ' HB3' ' CE1' ' A' ' 29' ' ' TYR . 9.5 pt-20 -93.02 -26.76 17.37 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.599 -0.688 . . . . 0.0 112.194 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.649 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.355 0 CA-C-O 121.363 0.601 . . . . 0.0 110.295 179.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 47.0 t . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.027 0.442 . . . . 0.0 109.855 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.704 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.59 -25.97 66.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.196 179.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.638 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 66.7 m -66.64 -28.56 68.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.745 0.783 . . . . 0.0 109.237 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.676 ' O ' HG13 ' C' ' 92' ' ' VAL . 46.5 tp -75.76 -25.07 56.16 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.116 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.704 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 34.8 mmm-85 -65.43 -35.88 82.25 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.638 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.34 -43.26 82.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.364 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -63.6 -32.43 73.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.75 178.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.676 HG13 ' O ' ' C' ' 88' ' ' LEU . 6.0 m -74.91 -23.05 17.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.879 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.801 ' HA ' HE21 ' C' ' 96' ' ' GLN . 55.8 mt-10 -67.96 -29.81 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.46 -55.1 11.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.135 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.4 mm? -59.1 -37.92 78.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.685 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.801 HE21 ' HA ' ' C' ' 93' ' ' GLU . 24.1 pt20 -73.78 -28.03 61.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.412 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.751 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -67.09 -33.07 82.28 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.736 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 92.6 mm-40 -70.15 -47.26 62.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.159 -0.52 . . . . 0.0 110.422 178.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.62 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.735 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.751 HE21 ' HA2' ' C' ' 97' ' ' GLY . 17.4 pt20 -59.7 -44.84 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.455 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.529 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.2 p-80 -76.83 -18.82 58.15 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.504 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.2 mt -70.93 -38.24 72.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.704 ' HG2' HD21 ' B' ' 62' ' ' LEU . 72.9 mt-30 -72.08 -30.07 64.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.96 -57.7 11.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.468 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.532 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.62 -40.3 96.54 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.828 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.434 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.15 -25.82 47.87 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.346 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 13.1 t -60.28 -27.83 67.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 0.0 110.72 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . 0.678 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 14.6 mm100 -89.75 -32.69 16.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.828 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.56 ' CE1' ' HB3' ' A' ' 33' ' ' GLU . 22.1 m-85 -79.17 -18.29 53.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.664 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.495 ' HA ' ' OH ' ' B' ' 69' ' ' TYR . 9.0 tmtt? -55.46 -47.33 76.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.62 -179.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.788 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.4 OUTLIER -90.12 38.08 0.92 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.419 0.628 . . . . 0.0 111.111 179.626 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.686 HG12 HG11 ' B' ' 72' ' ' VAL . 92.7 t -122.15 2.66 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.339 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' B' ' 69' ' ' TYR . 9.8 pt-20 -92.04 -29.55 16.52 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.355 -0.841 . . . . 0.0 112.452 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.544 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.702 0 C-N-CA 124.033 0.933 . . . . 0.0 110.539 178.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 45' ' ' VAL . 44.4 t . . . . . 0 CA--C 1.527 0.086 0 CA-C-O 120.908 0.385 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.53 -34.95 74.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.312 0.577 . . . . 0.0 109.681 178.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.9 m -71.9 -19.54 61.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.987 0.898 . . . . 0.0 108.695 177.398 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.556 ' O ' HG23 ' A' ' 12' ' ' VAL . 36.6 tp -72.62 -28.05 62.52 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.442 179.663 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 29.8 mmm-85 -62.42 -22.71 66.39 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.975 179.075 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.2 mt-30 -74.28 -35.66 63.76 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.84 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 99.0 mm-40 -71.53 -25.53 62.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 178.16 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.558 HG13 HD11 ' C' ' 95' ' ' LEU . 60.1 t -75.42 -40.26 42.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.367 178.684 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -62.17 -33.55 74.74 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.73 -55.17 18.76 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 113.974 -1.466 . . . . 0.0 110.772 178.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.584 HD11 HG13 ' B' ' 52' ' ' VAL . 78.8 mt -55.11 -45.18 75.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.719 -179.334 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 23.4 pt20 -72.66 -25.2 61.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 -179.553 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.75 -31.78 76.63 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 177.552 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.669 ' HB3' HG11 ' B' ' 59' ' ' VAL . 14.1 mm100 -71.51 -40.34 70.21 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.112 178.392 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' C' ' 98' ' ' GLN . 2.9 t -67.12 -44.98 87.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.523 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.7 pt20 -61.47 -43.09 99.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.678 -178.548 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.1 p-80 -77.75 -17.63 57.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.175 -179.667 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.671 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.2 mp -77.12 -35.54 56.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 120.099 -0.641 . . . . 0.0 109.56 178.518 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HG2' HD21 ' C' ' 102' ' ' LEU . 66.2 mt-30 -74.97 -30.63 61.25 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.29 -53.9 53.04 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.229 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.68 -46.71 86.65 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.508 178.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.407 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -47.88 -33.1 7.04 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 123.86 0.725 . . . . 0.0 112.502 179.558 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t -53.96 -34.01 58.53 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.853 0.358 . . . . 0.0 111.582 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -86.05 -12.77 49.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.865 0.364 . . . . 0.0 111.522 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.768 ' O ' HG22 ' A' ' 32' ' ' VAL . 62.4 m-85 -103.74 -16.03 15.56 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.348 0.594 . . . . 0.0 109.509 179.347 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.605 ' HA ' ' HE2' ' C' ' 109' ' ' TYR . 82.5 mttt -63.49 -17.74 63.07 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.443 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.597 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -102.25 22.82 12.65 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.563 179.03 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.768 HG22 ' O ' ' A' ' 29' ' ' TYR . 4.3 m -119.06 -14.72 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 121.838 -0.539 . . . . 0.0 111.964 179.745 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.482 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 10.7 pt-20 -75.43 -28.63 59.44 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.597 HD11 ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.702 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -175.093 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.722 HG11 HG22 ' A' ' 5' ' ' VAL . 45.0 t . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 120.796 0.331 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -69.77 -35.73 75.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.486 178.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 47' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 32.8 m -69.99 -19.95 63.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.089 0.947 . . . . 0.0 108.63 177.159 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 48' ' ' LEU . . . . . 0.515 ' O ' HG23 ' B' ' 52' ' ' VAL . 33.4 tp -72.29 -28.92 63.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 49' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 31.5 mmm-85 -61.26 -24.14 66.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.949 179.014 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 50' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.1 mt-30 -72.67 -36.74 67.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.984 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 98.9 mm-40 -70.45 -26.13 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.496 178.108 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.584 HG13 HD11 ' A' ' 15' ' ' LEU . 57.7 t -74.73 -40.72 47.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.357 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.88 -33.75 74.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 54' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.21 -55.04 20.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.916 178.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 55' ' ' LEU . . . . . 0.534 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -55.53 -44.98 77.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.653 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 56' ' ' GLN . . . . . 0.487 ' O ' ' HG2' ' B' ' 60' ' ' GLN . 24.1 pt20 -72.83 -24.94 60.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 57' ' ' GLY . . . . . 0.502 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.19 -30.9 73.95 Favored Glycine 0 C--O 1.237 0.302 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.705 ' HB3' HG21 ' C' ' 99' ' ' VAL . 14.1 mm100 -72.02 -41.75 67.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.168 -0.516 . . . . 0.0 109.933 178.433 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.669 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.9 t -65.42 -46.21 90.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.402 179.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 60' ' ' GLN . . . . . 0.502 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 8.9 pt20 -60.58 -43.01 97.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.762 -178.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 61' ' ' HIS . . . . . 0.489 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.1 p-80 -78.28 -16.82 57.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 62' ' ' LEU . . . . . 0.657 ' HG ' ' HE2' ' C' ' 106' ' ' PHE . 1.2 mp -77.56 -36.29 52.32 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.402 178.453 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.671 ' HG2' HD11 ' A' ' 22' ' ' LEU . 66.2 mt-30 -73.79 -31.49 63.3 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 64' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.1 -54.4 47.17 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.689 177.111 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 65' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' B' ' 69' ' ' TYR . . . -58.27 -47.12 84.61 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.3 178.413 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 66' ' ' PHE . . . . . 0.641 ' HE2' ' HG ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -47.58 -33.09 6.12 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 123.838 0.711 . . . . 0.0 112.682 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -54.58 -33.85 60.96 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 0.0 111.524 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -86.03 -12.22 50.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.912 0.387 . . . . 0.0 111.472 179.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 69' ' ' TYR . . . . . 0.789 ' O ' HG22 ' B' ' 72' ' ' VAL . 61.9 m-85 -104.05 -16.67 15.22 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.494 0.664 . . . . 0.0 109.327 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 29' ' ' TYR . 83.5 mttt -62.85 -17.97 62.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.407 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.607 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -101.85 22.53 12.8 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.594 178.716 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 72' ' ' VAL . . . . . 0.789 HG22 ' O ' ' B' ' 69' ' ' TYR . 4.2 m -118.89 -14.4 9.22 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 O-C-N 121.871 -0.518 . . . . 0.0 112.028 179.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 73' ' ' GLU . . . . . 0.475 ' HG3' ' HG ' ' B' ' 74' ' ' LEU . 11.5 pt-20 -75.53 -28.55 59.14 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' B' ' 71' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.64 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 -175.09 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 85' ' ' VAL . . . . . 0.681 HG22 HG11 ' A' ' 5' ' ' VAL . 47.2 t . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.026 0.441 . . . . 0.0 109.962 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 86' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.86 -35.93 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.393 0.616 . . . . 0.0 109.678 178.831 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 87' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 44.5 m -70.9 -19.9 62.55 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.057 0.932 . . . . 0.0 108.966 177.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 88' ' ' LEU . . . . . 0.54 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 35.9 tp -71.83 -28.56 63.65 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.538 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 89' ' ' ARG . . . . . 0.766 ' HA ' HG13 ' C' ' 92' ' ' VAL . 26.2 mmm-85 -63.09 -22.82 67.12 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.041 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 90' ' ' GLN . . . . . 0.698 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.0 OUTLIER -73.77 -35.25 64.96 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.886 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 91' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 99.0 mm-40 -70.98 -28.7 64.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.976 177.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 92' ' ' VAL . . . . . 0.766 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -79.08 -31.49 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 119.982 -0.687 . . . . 0.0 110.359 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 93' ' ' GLU . . . . . 0.466 ' HA ' HE21 ' C' ' 96' ' ' GLN . 46.5 tp10 -63.37 -34.74 78.37 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 94' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -66.53 -52.43 45.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.244 -1.344 . . . . 0.0 111.256 178.294 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 95' ' ' LEU . . . . . 0.558 HD11 HG13 ' A' ' 12' ' ' VAL . 83.9 mt -56.79 -42.95 80.39 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.788 -1.096 . . . . 0.0 111.464 -179.257 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 96' ' ' GLN . . . . . 0.581 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 25.3 pt20 -74.8 -25.11 58.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.938 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 97' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -68.23 -30.6 73.72 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 177.421 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 98' ' ' GLN . . . . . 0.602 ' HB3' HG11 ' A' ' 19' ' ' VAL . 14.6 mm100 -73.31 -43.12 61.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.934 -0.633 . . . . 0.0 110.495 178.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 99' ' ' VAL . . . . . 0.705 HG21 ' HB3' ' B' ' 58' ' ' GLN . 0.2 OUTLIER -71.52 -34.18 52.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.249 -179.399 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 100' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.5 pt20 -65.32 -43.18 91.8 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.104 177.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 101' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.6 p-80 -78.5 -17.33 56.4 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.563 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 102' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 4.0 mt -74.2 -37.82 63.8 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 103' ' ' GLN . . . . . 0.648 ' HG2' HD11 ' B' ' 62' ' ' LEU . 63.8 mt-30 -72.46 -31.78 65.71 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.584 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 104' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.28 -53.79 54.16 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.543 177.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 105' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' C' ' 109' ' ' TYR . . . -59.32 -46.44 88.57 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.556 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 106' ' ' PHE . . . . . 0.657 ' HE2' ' HG ' ' B' ' 62' ' ' LEU . 0.7 OUTLIER -48.19 -32.94 7.73 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.795 0.684 . . . . 0.0 112.119 179.502 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 38.8 t -53.47 -35.7 60.85 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.913 0.387 . . . . 0.0 111.314 -179.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -84.93 -12.95 52.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.894 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' C' C ' 109' ' ' TYR . . . . . 0.797 ' O ' HG22 ' C' ' 112' ' ' VAL . 62.8 m-85 -103.43 -16.18 15.67 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.633 0.73 . . . . 0.0 109.418 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 110' ' ' LYS . . . . . 0.598 ' HA ' ' HE2' ' B' ' 69' ' ' TYR . 82.7 mttt -62.69 -18.46 62.49 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.291 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 111' ' ' LYS . . . . . 0.562 ' HA ' HD11 ' C' ' 114' ' ' LEU . 0.2 OUTLIER -101.65 21.85 13.74 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.313 -0.955 . . . . 0.0 111.868 179.046 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' C' C ' 112' ' ' VAL . . . . . 0.797 HG22 ' O ' ' C' ' 109' ' ' TYR . 4.4 m -118.47 -13.57 10.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 O-C-N 121.893 -0.505 . . . . 0.0 112.285 179.469 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 113' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' C' ' 114' ' ' LEU . 10.6 pt-20 -76.85 -28.83 55.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' C' C ' 114' ' ' LEU . . . . . 0.562 HD11 ' HA ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.318 -0.79 0 CA-C-N 115.031 -0.986 . . . . 0.0 113.578 -175.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.484 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.989 0 N-CA-C 111.941 -0.463 . . . . 0.0 111.941 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.652 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 98.2 mt -58.64 -57.88 23.33 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-O 119.207 -0.425 . . . . 0.0 111.043 179.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.652 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 75.2 Cg_exo -44.98 -46.19 13.34 Favored 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 122.794 2.329 . . . . 0.0 112.785 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.415 ' HA ' ' HB2' ' A' ' 7' ' ' SER . 38.8 t70 -62.61 -31.65 72.52 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.59 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.518 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 78.5 t -58.37 -55.7 20.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.59 -23.64 65.41 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.093 178.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.681 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 52.8 m -72.73 -21.26 61.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.571 0.7 . . . . 0.0 110.475 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 23.7 tp -76.56 -18.72 58.52 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.544 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 5.6 mpt_? -73.8 -40.21 63.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.564 178.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.681 ' HG3' ' O ' ' A' ' 7' ' ' SER . 4.0 pt20 -71.93 -30.35 65.24 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.526 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 37.4 tt0 -69.63 -28.62 66.06 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 122.116 0.96 . . . . 0.0 108.479 177.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 t -74.48 -32.73 30.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 114.273 -1.33 . . . . 0.0 109.444 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.671 ' HA ' HE21 ' A' ' 16' ' ' GLN . 51.0 mt-10 -71.31 -26.54 62.89 Favored 'General case' 0 C--N 1.333 -0.146 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.32 -41.19 73.58 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.477 177.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 37.3 tp -63.47 -38.42 91.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.385 -1.28 . . . . 0.0 110.107 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.671 HE21 ' HA ' ' A' ' 13' ' ' GLU . 26.2 pt20 -77.0 -21.27 54.93 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.131 -0.628 . . . . 0.0 109.844 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.897 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -71.36 -33.68 64.28 Favored Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 110.085 -1.206 . . . . 0.0 110.085 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.658 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 3.8 mm100 -70.65 -44.6 66.8 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.472 -0.364 . . . . 0.0 110.474 178.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.536 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.1 p -70.12 -31.69 48.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 C-N-CA 120.18 -0.608 . . . . 0.0 111.734 -178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.897 HE21 ' HA2' ' A' ' 17' ' ' GLY . 19.2 pt20 -71.91 -38.73 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.4 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.658 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 12.0 p-80 -79.96 -18.0 51.52 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.197 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.713 ' O ' ' HB2' ' A' ' 26' ' ' PHE . 1.8 mp -79.47 -28.81 41.55 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.531 ' HG2' HD11 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -76.97 -29.11 55.4 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -60.01 -60.92 3.07 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.233 -1.349 . . . . 0.0 109.581 177.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.53 -41.4 94.35 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.845 -1.07 . . . . 0.0 109.542 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.713 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.04 -28.12 56.1 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.898 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t -60.07 -31.96 70.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.226 0.536 . . . . 0.0 110.77 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -76.82 -48.16 19.33 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.586 178.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.628 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 34.5 m-85 -70.89 -15.55 62.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.537 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 37.2 ttmt -66.17 -40.64 90.65 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.21 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.98 32.41 2.4 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.738 0.78 . . . . 0.0 110.123 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 6.6 t -94.81 -36.41 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.265 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.414 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 38.5 tt0 -101.89 103.75 14.45 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-O 122.493 1.14 . . . . 0.0 110.498 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.699 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -172.84 -27.23 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 112.566 -2.106 . . . . 0.0 108.991 -179.653 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.699 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -132.53 43.94 1.2 Allowed Pre-proline 0 CA--C 1.548 0.867 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.487 176.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 39.5 Cg_endo -65.62 -179.21 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 122.486 2.124 . . . . 0.0 113.355 -179.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -82.96 162.71 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.432 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -179.3 164.48 32.64 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.014 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 91.04 -156.95 24.72 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.745 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 5.3 tt . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.353 -0.832 . . . . 0.0 110.324 179.729 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.477 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.756 -0.538 . . . . 0.0 111.756 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.638 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 99.2 mt -57.21 -58.08 20.43 Favored Pre-proline 0 N--CA 1.467 0.412 0 CA-C-O 119.265 -0.398 . . . . 0.0 111.564 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.638 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.8 Cg_exo -45.64 -45.43 16.36 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 122.595 2.197 . . . . 0.0 112.773 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.419 ' HA ' ' HB2' ' B' ' 47' ' ' SER . 38.6 t70 -63.27 -30.89 71.94 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.377 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.517 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 70.7 t -58.84 -55.52 22.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.52 -23.97 65.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.158 178.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.9 m -72.21 -22.09 61.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.436 0.636 . . . . 0.0 110.526 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 23.4 tp -75.82 -18.51 59.45 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 177.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' B' ' 46' ' ' ALA . 5.4 mpt_? -74.1 -39.38 63.44 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.516 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.7 pt20 -72.42 -30.77 64.93 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.6 tt0 -69.14 -28.25 66.28 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.105 0.955 . . . . 0.0 108.518 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 1.1 t -75.32 -32.74 26.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 114.44 -1.254 . . . . 0.0 109.453 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.633 ' HA ' HE21 ' B' ' 56' ' ' GLN . 49.0 mt-10 -70.94 -26.39 63.17 Favored 'General case' 0 N--CA 1.456 -0.129 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 176.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.92 -42.03 73.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.447 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 37.1 tp -63.07 -38.38 90.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.334 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.633 HE21 ' HA ' ' B' ' 53' ' ' GLU . 25.4 pt20 -76.95 -20.77 55.74 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.836 178.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.886 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -72.13 -33.64 62.02 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 177.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.637 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 3.5 mm100 -70.04 -44.75 68.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.954 0.407 . . . . 0.0 110.357 178.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.2 p -69.89 -32.12 50.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 C-N-CA 120.225 -0.59 . . . . 0.0 111.891 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.886 HE21 ' HA2' ' B' ' 57' ' ' GLY . 17.6 pt20 -71.89 -38.77 69.93 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.347 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.637 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 11.3 p-80 -79.78 -17.68 52.84 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.41 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.732 ' O ' ' HB2' ' B' ' 66' ' ' PHE . 1.9 mp -79.93 -29.12 39.67 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.55 ' HG2' HD11 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -75.85 -29.22 58.49 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 106.274 -1.75 . . . . 0.0 106.274 176.322 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -59.85 -61.66 2.45 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.163 -1.38 . . . . 0.0 109.627 177.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.515 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.43 -41.53 89.78 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.66 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.732 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.94 -29.15 59.69 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 114.882 -1.054 . . . . 0.0 112.108 -179.686 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 19.5 t -58.56 -34.06 70.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 118.004 0.366 . . . . 0.0 110.648 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.431 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 5.1 mm100 -75.21 -47.92 25.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.328 0.585 . . . . 0.0 109.9 178.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.622 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 33.9 m-85 -70.94 -16.13 62.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.323 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 37.1 ttmt -66.51 -39.98 88.97 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.443 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.482 ' H ' ' HG3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -98.23 31.39 2.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.684 0.754 . . . . 0.0 109.908 178.819 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.622 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -93.82 -36.66 7.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.267 179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -102.25 101.86 12.19 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 122.532 1.158 . . . . 0.0 111.145 178.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.699 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -170.55 -27.18 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 112.411 -2.177 . . . . 0.0 108.837 -179.933 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.699 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -131.58 43.92 1.23 Allowed Pre-proline 0 CA--C 1.548 0.866 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.454 176.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.424 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 39.0 Cg_endo -65.58 -179.19 1.13 Allowed 'Trans proline' 0 C--N 1.359 1.081 0 C-N-CA 122.254 1.969 . . . . 0.0 113.629 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -82.61 162.7 21.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.156 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.99 165.63 34.7 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.616 -0.802 . . . . 0.0 111.796 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.9 -156.61 25.57 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.201 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 5.2 tt . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.273 179.869 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.519 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.93 -0.468 . . . . 0.0 111.93 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.678 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 98.0 mt -59.62 -56.53 34.88 Favored Pre-proline 0 CA--C 1.534 0.354 0 CA-C-O 119.414 -0.326 . . . . 0.0 111.718 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.678 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 74.4 Cg_exo -46.34 -45.46 18.73 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 122.907 2.405 . . . . 0.0 112.818 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . 0.412 ' HA ' ' HB2' ' C' ' 87' ' ' SER . 35.8 t70 -62.53 -33.28 74.59 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.484 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.559 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 76.3 t -57.18 -55.81 18.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.55 -24.14 65.5 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.247 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 56.1 m -72.01 -22.02 61.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.539 0.685 . . . . 0.0 110.207 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.696 ' O ' HG13 ' C' ' 92' ' ' VAL . 25.6 tp -75.69 -19.12 59.34 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.693 ' O ' HG22 ' C' ' 92' ' ' VAL . 4.6 mpt_? -75.94 -36.94 59.18 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.313 178.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 4.0 pt20 -73.26 -29.49 62.79 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.464 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 36.5 tt0 -69.77 -30.33 67.87 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 177.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.696 HG13 ' O ' ' C' ' 88' ' ' LEU . 16.0 m -75.85 -27.9 18.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.439 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.738 178.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.675 ' HA ' HE21 ' C' ' 96' ' ' GLN . 52.3 mt-10 -70.26 -28.17 65.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -70.11 -41.0 74.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.542 177.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 40.2 tp -63.77 -37.52 87.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.27 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.675 HE21 ' HA ' ' C' ' 93' ' ' GLU . 26.2 pt20 -77.69 -21.35 52.16 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.727 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.882 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -71.22 -34.07 64.51 Favored Glycine 0 N--CA 1.445 -0.742 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.661 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 3.1 mm100 -69.84 -44.87 69.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.328 -0.436 . . . . 0.0 110.317 178.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.546 HG12 ' HA ' ' C' ' 96' ' ' GLN . 10.0 p -70.22 -30.99 45.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.104 -0.639 . . . . 0.0 112.204 -178.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.882 HE21 ' HA2' ' C' ' 97' ' ' GLY . 19.2 pt20 -72.69 -38.86 67.41 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.001 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.661 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 12.3 p-80 -80.07 -17.16 53.41 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 119.448 -0.901 . . . . 0.0 110.21 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' C' ' 106' ' ' PHE . 1.8 mp -79.79 -29.27 40.29 Favored 'General case' 0 N--CA 1.444 -0.727 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -76.91 -28.83 55.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 176.359 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.53 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.84 -61.86 2.3 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.514 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.517 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.12 -41.5 88.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.648 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.647 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.01 -31.44 61.05 Favored 'General case' 0 C--O 1.204 -1.313 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.724 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 15.4 t -55.74 -34.62 65.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.902 0.382 . . . . 0.0 110.728 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.414 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 4.2 mm100 -75.38 -49.11 20.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.302 0.572 . . . . 0.0 109.967 178.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.616 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 32.7 m-85 -70.36 -16.13 62.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.792 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.415 ' N ' ' O ' ' C' ' 106' ' ' PHE . 30.1 ttmt -69.32 -34.67 75.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.647 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.469 ' HG3' ' H ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER -101.5 30.66 4.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.452 0.644 . . . . 0.0 109.582 177.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.616 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.2 t -93.47 -37.25 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.337 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.431 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 37.2 tt0 -101.45 102.71 13.55 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-O 122.404 1.097 . . . . 0.0 110.559 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.721 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -170.77 -28.56 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.792 -179.753 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.721 ' H ' HD23 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -131.15 44.38 1.37 Allowed Pre-proline 0 CA--C 1.55 0.972 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.288 176.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 44.0 Cg_endo -66.33 179.36 2.04 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 122.233 1.956 . . . . 0.0 113.309 -178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -79.98 164.26 23.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.467 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 179.3 165.37 33.4 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.811 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 88.55 -160.8 30.6 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.157 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.243 0.754 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.45 179.932 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.41 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.937 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.589 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 91.0 mt -60.0 -56.02 39.75 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.099 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.589 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 76.9 Cg_exo -42.41 -48.67 6.68 Favored 'Trans proline' 0 C--N 1.361 1.21 0 C-N-CA 123.081 2.521 . . . . 0.0 113.179 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -57.7 -44.5 85.93 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.017 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 1' ' ' GLY . 93.5 t -61.58 -51.27 74.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.621 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.67 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.86 -27.34 68.15 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.511 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 75.2 m -67.7 -28.46 67.7 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.07 0.462 . . . . 0.0 109.847 178.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.2 tp -75.48 -21.66 57.88 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.622 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.719 ' HA ' HG22 ' A' ' 12' ' ' VAL . 39.0 mmm-85 -65.4 -21.53 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' A' ' 7' ' ' SER . 6.6 mt-30 -73.39 -42.83 61.66 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -70.86 -29.29 65.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.782 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.719 HG22 ' HA ' ' A' ' 9' ' ' ARG . 28.3 m -76.42 -40.87 35.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.634 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.82 -24.13 61.67 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.07 -55.29 14.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.552 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' B' ' 56' ' ' GLN . 12.3 tp -58.92 -34.12 71.36 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 114.412 -1.267 . . . . 0.0 110.295 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 15.4 tt0 -67.12 -38.31 85.37 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.484 179.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.494 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -61.4 -31.72 78.39 Favored Glycine 0 C--O 1.237 0.324 0 C-N-CA 120.814 -0.707 . . . . 0.0 111.753 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.684 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 95.6 mm-40 -72.94 -49.95 26.37 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.519 HG11 HD22 ' C' ' 95' ' ' LEU . 10.2 p -66.41 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 112.056 0.391 . . . . 0.0 112.056 -178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.3 pt20 -68.88 -42.97 76.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.099 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.544 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.8 p-80 -75.81 -17.29 59.9 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.8 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.684 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 12.3 mt -73.57 -37.3 65.56 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 176.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.6 tm0? -70.65 -29.26 65.57 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.38 -62.13 2.07 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.086 178.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.478 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.18 -41.15 92.29 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.08 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.609 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -56.04 -28.98 59.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.232 -0.894 . . . . 0.0 112.12 -179.85 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.0 t -61.6 -31.88 71.96 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.028 0.442 . . . . 0.0 110.259 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.452 HE21 ' HA ' ' A' ' 25' ' ' ALA . 52.1 mt-30 -73.97 -52.04 14.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.59 0.71 . . . . 0.0 109.508 178.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.534 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 56.8 m-85 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.826 -1.079 . . . . 0.0 111.238 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -62.29 -41.1 98.22 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.098 -0.955 . . . . 0.0 110.851 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.495 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -96.36 29.67 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.49 0.662 . . . . 0.0 111.272 179.56 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.554 HG21 ' HB2' ' B' ' 73' ' ' GLU . 3.5 t -96.3 -41.12 11.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.594 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.729 ' HB2' HG11 ' C' ' 112' ' ' VAL . 19.3 tt0 -102.74 105.43 15.87 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.63 0.729 . . . . 0.0 109.833 177.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.83 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -175.56 -31.43 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.153 -1.385 . . . . 0.0 110.36 -179.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.83 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -121.62 19.06 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 178.754 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.763 ' HD3' ' H ' ' A' ' 34' ' ' LEU . 44.4 Cg_endo -86.87 -158.97 0.09 OUTLIER 'Trans proline' 0 C--N 1.367 1.523 0 CA-C-N 121.684 1.637 . . . . 0.0 112.409 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -114.98 -152.27 0.5 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.302 -0.408 . . . . 0.0 109.997 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.545 ' HA2' ' HE2' ' C' ' 115' ' ' PHE . . . 143.72 -117.8 1.12 Allowed Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -82.78 -4.94 89.84 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.493 -0.861 . . . . 0.0 111.505 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 12.4 tt . . . . . 0 C--O 1.244 0.764 0 CA-C-O 118.755 -0.64 . . . . 0.0 109.792 179.855 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.41 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.487 2.043 0 N-CA-C 111.926 -0.469 . . . . 0.0 111.926 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.595 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 91.8 mt -60.37 -56.37 35.97 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-O 119.229 -0.415 . . . . 0.0 111.431 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.595 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.6 Cg_exo -41.4 -49.26 5.06 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.169 2.58 . . . . 0.0 113.211 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -57.14 -46.02 83.05 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.127 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.41 HG23 ' O ' ' B' ' 41' ' ' GLY . 86.4 t -60.92 -50.81 79.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.593 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.644 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.24 -27.62 68.1 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.443 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.664 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 69.7 m -67.68 -27.89 67.23 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.011 0.434 . . . . 0.0 109.965 178.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.46 -21.56 58.0 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.574 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.734 ' HA ' HG22 ' B' ' 52' ' ' VAL . 39.5 mmm-85 -65.38 -21.97 66.74 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.664 ' HG3' ' O ' ' B' ' 47' ' ' SER . 5.8 mt-30 -72.99 -42.09 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.623 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -71.85 -28.48 63.57 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.51 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' B' ' 49' ' ' ARG . 30.4 m -77.06 -42.25 31.65 Favored 'Isoleucine or valine' 0 C--N 1.34 0.16 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.444 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -69.95 -25.3 63.57 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.13 -55.2 17.59 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.623 HD11 ' HA ' ' C' ' 96' ' ' GLN . 12.5 tp -59.27 -33.5 71.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.382 -1.281 . . . . 0.0 110.251 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.59 ' HA ' HD11 ' A' ' 15' ' ' LEU . 14.3 tt0 -67.15 -39.2 86.49 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.521 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.507 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -61.06 -31.72 77.72 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.96 -0.638 . . . . 0.0 111.766 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.701 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 96.0 mm-40 -72.76 -49.5 30.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.02 0.438 . . . . 0.0 111.114 179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.445 HG12 ' HA ' ' B' ' 56' ' ' GLN . 9.8 p -66.99 -32.18 56.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 8.0 pt20 -69.96 -42.87 72.6 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.986 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.539 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.8 p-80 -75.74 -17.29 59.96 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.312 -0.955 . . . . 0.0 109.671 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 12.0 mt -73.34 -37.11 66.22 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 176.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.495 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.2 tm0? -70.6 -29.98 66.53 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.39 -63.51 1.2 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.068 178.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.459 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.37 -40.99 88.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.134 179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.618 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.2 OUTLIER -56.62 -28.7 61.06 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.225 -179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 30.1 t -62.0 -30.68 71.11 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.212 0.53 . . . . 0.0 110.549 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.423 HE21 ' HA ' ' B' ' 65' ' ' ALA . 54.8 mt-30 -75.07 -51.21 14.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.584 0.706 . . . . 0.0 109.389 178.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' B' ' 72' ' ' VAL . 61.0 m-85 -66.28 -16.42 64.01 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.299 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -61.67 -41.79 98.03 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.879 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.505 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -95.83 29.42 2.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.362 0.601 . . . . 0.0 111.543 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' C' ' 113' ' ' GLU . 3.6 t -96.28 -40.24 10.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.457 179.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.554 ' HB2' HG21 ' A' ' 32' ' ' VAL . 19.1 tt0 -103.68 105.36 15.56 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-O 122.011 0.91 . . . . 0.0 109.922 177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.799 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -175.63 -31.38 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.658 0 CA-C-N 113.323 -1.762 . . . . 0.0 110.316 -179.316 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.799 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -121.89 18.83 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 178.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.749 ' HD3' ' H ' ' B' ' 74' ' ' LEU . 41.9 Cg_endo -87.62 -159.53 0.09 OUTLIER 'Trans proline' 0 C--N 1.365 1.427 0 CA-C-N 121.52 1.579 . . . . 0.0 112.057 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -114.12 -151.85 0.49 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.1 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . 0.535 ' HA2' ' HE2' ' A' ' 35' ' ' PHE . . . 144.63 -115.29 0.85 Allowed Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.24 -5.87 84.94 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.527 -0.845 . . . . 0.0 111.218 178.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 10.4 tt . . . . . 0 C--O 1.245 0.83 0 CA-C-O 118.852 -0.594 . . . . 0.0 110.098 179.879 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 112.158 -0.377 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.591 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 91.0 mt -56.91 -56.47 32.89 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.277 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.591 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 78.1 Cg_exo -42.41 -48.63 6.71 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 123.173 2.582 . . . . 0.0 113.226 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -57.49 -45.11 85.26 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.023 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 97.8 t -61.1 -51.95 67.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.793 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.686 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.42 -26.97 68.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.394 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 75.5 m -68.07 -28.32 67.26 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.157 0.503 . . . . 0.0 109.956 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 43.4 tp -75.36 -21.54 58.26 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.333 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.686 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 42.6 mmm-85 -63.92 -23.65 67.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.694 178.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' C' ' 87' ' ' SER . 5.8 mt-30 -72.48 -44.55 62.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.169 -179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -69.26 -27.46 65.45 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.788 0.804 . . . . 0.0 110.795 179.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.2 t -76.27 -45.11 35.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.564 -1.198 . . . . 0.0 111.525 -178.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -72.4 -21.8 61.22 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.2 -55.47 13.92 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.375 177.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.519 HD22 HG11 ' A' ' 19' ' ' VAL . 1.4 mt -56.46 -38.18 71.31 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 114.519 -1.219 . . . . 0.0 110.118 178.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.623 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.0 tt0 -64.23 -38.98 92.97 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.163 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.503 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.88 -31.65 79.12 Favored Glycine 0 C--O 1.238 0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.587 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.697 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 96.2 mm-40 -73.04 -50.04 25.32 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.13 0.49 . . . . 0.0 111.189 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.492 HG12 ' HA ' ' C' ' 96' ' ' GLN . 9.6 p -66.37 -33.11 61.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 8.0 pt20 -68.94 -43.41 75.12 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.065 -0.254 . . . . 0.0 111.026 179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.553 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 6.6 p-80 -75.53 -17.06 60.19 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 119.453 -0.899 . . . . 0.0 109.967 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.697 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 12.8 mt -74.25 -36.62 63.88 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 176.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.534 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.1 tm0? -70.94 -29.18 65.13 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 177.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.553 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.19 -63.07 1.39 Allowed 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.829 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.465 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.39 -42.01 90.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.136 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.635 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.2 OUTLIER -55.57 -29.1 58.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.174 -0.921 . . . . 0.0 112.308 -179.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 10.6 t -61.98 -30.62 71.06 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.028 0.442 . . . . 0.0 110.653 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.415 HE21 ' HA ' ' C' ' 105' ' ' ALA . 53.1 mt-30 -75.56 -51.1 13.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.594 0.712 . . . . 0.0 109.401 178.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.634 ' HA ' HG13 ' C' ' 112' ' ' VAL . 58.7 m-85 -66.03 -17.38 64.65 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.016 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -60.76 -39.49 88.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.08 -0.963 . . . . 0.0 110.907 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.501 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -97.56 26.64 4.83 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.729 HG11 ' HB2' ' A' ' 33' ' ' GLU . 1.1 m -99.41 -30.58 3.43 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.816 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.542 ' HB2' HG21 ' B' ' 72' ' ' VAL . 18.4 tt0 -102.95 103.22 13.33 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-O 121.922 0.868 . . . . 0.0 109.566 176.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.849 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -176.17 -32.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 113.399 -1.728 . . . . 0.0 110.329 -179.111 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.849 ' H ' HD23 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -121.15 18.77 0.08 OUTLIER Pre-proline 0 CA--C 1.552 1.053 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 178.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.759 ' HD3' ' H ' ' C' ' 114' ' ' LEU . 60.6 Cg_endo -86.93 -159.2 0.09 OUTLIER 'Trans proline' 0 C--N 1.37 1.676 0 CA-C-N 121.504 1.573 . . . . 0.0 112.308 179.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -114.25 -149.4 0.45 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . 0.568 ' HA2' ' HE2' ' B' ' 75' ' ' PHE . . . 142.05 -115.6 0.99 Allowed Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.078 -0.809 . . . . 0.0 111.078 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -85.37 -6.41 83.97 Favored Glycine 0 N--CA 1.454 -0.149 0 C-N-CA 120.574 -0.822 . . . . 0.0 111.567 178.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 11.5 tt . . . . . 0 C--O 1.245 0.858 0 CA-C-O 118.594 -0.717 . . . . 0.0 110.187 -179.859 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.487 2.045 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.432 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 9.7 mp -56.7 -57.1 26.03 Favored Pre-proline 0 N--CA 1.464 0.271 0 CA-C-O 119.345 -0.36 . . . . 0.0 111.575 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.432 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 50.1 Cg_exo -42.28 -48.27 6.7 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 123.141 2.561 . . . . 0.0 113.459 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -63.64 -45.8 88.56 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.923 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.563 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 85.2 t -62.07 -36.33 73.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.257 179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.606 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.28 -33.47 69.79 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.708 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -69.45 -20.25 63.76 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.416 1.103 . . . . 0.0 108.294 177.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.563 ' HB3' ' O ' ' A' ' 5' ' ' VAL . 28.6 tp -76.3 -29.65 57.43 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.345 -1.298 . . . . 0.0 110.323 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.606 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 22.6 mmm-85 -66.37 -39.94 89.44 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.074 0.464 . . . . 0.0 109.997 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.708 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -69.76 -41.93 74.54 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.14 179.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 7.4 tt0 -66.62 -34.94 79.0 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 121.104 0.478 . . . . 0.0 111.377 179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.53 HG12 ' O ' ' A' ' 9' ' ' ARG . 5.7 p -76.97 -30.88 18.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.629 -178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -69.98 -30.56 67.93 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.47 -56.29 13.22 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.716 178.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.479 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.2 tp -58.39 -34.52 70.82 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.054 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.458 ' HA ' HD11 ' C' ' 95' ' ' LEU . 19.7 tt0 -65.27 -44.29 88.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.688 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.526 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -61.13 -31.31 76.33 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.625 179.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 69.8 mt-30 -71.95 -43.71 64.79 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.898 0.38 . . . . 0.0 110.584 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.479 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.2 t -67.52 -40.93 85.31 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.096 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.839 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.8 pt20 -61.98 -42.12 98.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.059 -179.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.477 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.3 p-80 -79.78 -17.16 54.08 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.771 -0.772 . . . . 0.0 111.024 -179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 11.5 mt -71.64 -41.19 69.1 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -70.82 -31.97 68.88 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.66 -55.43 34.98 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.755 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.673 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.89 -39.94 93.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.693 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.416 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.1 OUTLIER -55.05 -29.67 57.97 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.381 179.43 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -49.83 -26.87 4.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.029 0.442 . . . . 0.0 111.122 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.451 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 4.9 mm100 -96.66 -42.82 7.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.921 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.673 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.1 m-85 -73.58 -20.4 60.63 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -178.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 51.5 mtmt -70.38 -26.95 63.95 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.78 0.324 . . . . 0.0 110.64 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.451 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.64 31.6 5.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.74 0.781 . . . . 0.0 109.738 178.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.631 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 2.9 t -93.38 -42.12 12.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 0.0 111.238 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -97.71 100.05 11.43 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 122.336 1.065 . . . . 0.0 110.687 178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.678 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -171.58 -29.14 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 112.742 -2.026 . . . . 0.0 109.615 179.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.746 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 43.0 m-85 -63.07 -56.68 26.03 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.988 178.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.746 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 86.2 Cg_endo -83.66 172.49 10.11 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 122.28 1.987 . . . . 0.0 111.684 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -137.63 73.76 1.45 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.979 0.418 . . . . 0.0 109.939 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.27 4.15 90.3 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.021 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 90.76 -95.18 2.05 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.401 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.0 mt . . . . . 0 C--O 1.243 0.749 0 CA-C-O 117.87 -1.062 . . . . 0.0 111.583 178.586 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.433 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.878 0 N-CA-C 112.11 -0.396 . . . . 0.0 112.11 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.431 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 9.3 mp -57.68 -56.91 29.46 Favored Pre-proline 0 CA--C 1.535 0.39 0 CA-C-O 119.229 -0.415 . . . . 0.0 111.518 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.431 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 50.5 Cg_exo -42.37 -48.9 6.51 Favored 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 123.443 2.762 . . . . 0.0 113.369 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -62.78 -45.09 94.3 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.023 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.535 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 99.9 t -63.3 -36.15 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.422 178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -71.2 -33.74 70.22 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 48.3 m -69.51 -20.6 63.71 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 122.373 1.082 . . . . 0.0 108.611 176.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.535 ' HB3' ' O ' ' B' ' 45' ' ' VAL . 28.7 tp -75.95 -30.04 58.52 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.033 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 22.6 mmm-85 -66.21 -39.12 89.39 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.158 0.504 . . . . 0.0 110.319 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -70.24 -42.65 71.92 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.016 179.851 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 7.5 tt0 -65.55 -35.58 81.26 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.455 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.502 HG12 ' O ' ' B' ' 49' ' ' ARG . 5.4 p -76.52 -30.24 19.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.757 -178.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.86 -29.88 66.11 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -66.43 -56.3 11.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.454 178.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.493 HD11 ' HA ' ' C' ' 96' ' ' GLN . 27.3 tp -58.0 -34.47 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.077 -0.965 . . . . 0.0 110.039 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.442 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.4 tt0 -65.21 -45.09 86.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.571 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.493 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -60.07 -31.91 74.24 Favored Glycine 0 C--O 1.236 0.26 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.605 179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.8 mt-30 -71.3 -44.01 65.98 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.892 0.377 . . . . 0.0 110.681 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.467 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.0 t -67.35 -40.18 84.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.7 pt20 -63.2 -41.95 99.23 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.339 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.476 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.99 -18.11 54.23 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.676 -0.809 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 11.4 mt -71.14 -40.33 71.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.647 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -71.8 -31.77 66.91 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 178.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.7 -55.41 35.19 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.847 177.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.686 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.88 -40.91 97.02 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.636 178.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.1 OUTLIER -54.73 -29.12 52.66 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.573 179.306 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.8 t -50.35 -27.76 6.81 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 111.109 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.49 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 4.3 mm100 -95.41 -42.47 8.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.893 178.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.686 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 15.2 m-85 -74.06 -19.49 60.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 51.7 mtmt -71.11 -26.62 63.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.908 0.385 . . . . 0.0 110.612 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -106.69 31.57 5.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.682 0.753 . . . . 0.0 109.666 178.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 3.0 t -93.44 -42.51 13.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 114.626 -1.17 . . . . 0.0 110.991 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 38.3 tt0 -96.86 100.7 12.22 Favored 'General case' 0 CA--C 1.503 -0.838 0 CA-C-O 122.229 1.014 . . . . 0.0 110.846 178.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.703 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -172.57 -30.29 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 112.653 -2.067 . . . . 0.0 109.795 179.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.755 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 39.2 m-85 -62.3 -55.63 38.23 Favored Pre-proline 0 CA--C 1.536 0.422 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.262 177.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.755 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 89.1 Cg_endo -85.18 170.62 9.46 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.37 2.047 . . . . 0.0 111.442 179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -135.87 74.19 1.5 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.96 0.41 . . . . 0.0 110.227 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 81.36 6.13 89.49 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.98 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.75 -95.45 2.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.635 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.03 -0.986 . . . . 0.0 111.133 178.972 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.404 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.935 0 N-CA-C 112.049 -0.42 . . . . 0.0 112.049 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.439 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 9.1 mp -56.1 -56.36 31.75 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 119.359 -0.353 . . . . 0.0 111.772 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.439 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 51.6 Cg_exo -43.68 -46.97 10.0 Favored 'Trans proline' 0 C--N 1.36 1.163 0 C-N-CA 123.119 2.546 . . . . 0.0 113.391 -178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -64.52 -45.13 88.58 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.137 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.588 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 96.0 t -63.02 -36.35 75.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.143 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.25 -34.52 70.83 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 178.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.723 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.2 m -69.23 -20.79 63.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 122.264 1.031 . . . . 0.0 108.312 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.789 ' O ' HG22 ' C' ' 92' ' ' VAL . 30.2 tp -74.64 -31.7 62.05 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.313 -1.312 . . . . 0.0 109.991 178.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.588 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 23.5 mmm-85 -64.87 -40.15 94.69 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 123.663 0.602 . . . . 0.0 110.524 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.723 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.83 -42.0 82.14 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 7.8 tt0 -64.76 -37.05 86.29 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.077 178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.789 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -70.79 -38.82 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.709 0 C-N-CA 120.365 -0.534 . . . . 0.0 110.603 179.031 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.35 -31.13 71.72 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -67.1 -57.54 6.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.792 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.493 ' O ' HG23 ' C' ' 99' ' ' VAL . 26.7 tp -57.83 -34.69 69.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.297 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.493 ' HA ' HD11 ' B' ' 55' ' ' LEU . 21.7 tt0 -65.23 -44.83 86.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.489 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.425 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.21 -31.55 73.73 Favored Glycine 0 C--O 1.238 0.388 0 N-CA-C 111.629 -0.588 . . . . 0.0 111.629 178.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.734 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 71.9 mt-30 -72.52 -43.65 63.27 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.643 -0.328 . . . . 0.0 110.532 179.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.493 HG23 ' O ' ' C' ' 95' ' ' LEU . 59.6 t -67.63 -40.11 83.49 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.127 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.425 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 3.7 pt20 -62.87 -42.37 99.74 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 121.313 -0.155 . . . . 0.0 111.12 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.51 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 6.6 p-80 -79.24 -17.32 54.99 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.966 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.734 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 11.0 mt -71.51 -40.73 69.96 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 177.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.19 -32.27 68.65 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.54 -54.95 41.01 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.936 178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.692 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.28 -40.34 95.94 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.554 178.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.52 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -54.89 -29.32 55.47 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.473 179.028 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.8 t -49.64 -27.19 4.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.91 0.386 . . . . 0.0 111.298 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.432 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 4.4 mm100 -96.16 -43.31 7.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.924 178.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.692 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 14.4 m-85 -73.38 -20.36 60.77 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.223 0.823 . . . . 0.0 113.223 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.52 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 49.8 mtmt -70.74 -25.8 63.09 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.746 0.308 . . . . 0.0 110.675 -179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.475 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -108.48 32.8 4.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.823 0.82 . . . . 0.0 109.516 178.147 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.628 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 3.0 t -93.79 -42.87 13.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.733 -1.122 . . . . 0.0 110.861 179.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.536 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 32.3 tt0 -96.73 99.55 11.14 Favored 'General case' 0 CA--C 1.502 -0.883 0 CA-C-O 122.35 1.072 . . . . 0.0 111.149 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.667 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -169.95 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.767 0 CA-C-N 112.523 -2.126 . . . . 0.0 109.397 -179.731 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.763 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 41.2 m-85 -59.98 -57.51 26.23 Favored Pre-proline 0 CA--C 1.534 0.35 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.214 178.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.763 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 90.2 Cg_endo -84.2 170.85 10.58 Favored 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.231 1.954 . . . . 0.0 111.829 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -136.04 73.5 1.46 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.97 0.414 . . . . 0.0 110.129 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.39 5.54 89.48 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.983 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 89.22 -94.69 2.02 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.54 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 18.9 mt . . . . . 0 C--O 1.243 0.761 0 CA-C-O 118.01 -0.995 . . . . 0.0 111.289 179.031 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.527 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.834 0 N-CA-C 112.373 -0.291 . . . . 0.0 112.373 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.537 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 3.5 mm? -52.48 -56.83 18.95 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 8.3 Cg_endo -51.81 -37.42 65.61 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 123.229 2.619 . . . . 0.0 112.463 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.402 ' HA ' ' OG ' ' A' ' 7' ' ' SER . 31.1 m-20 -73.92 -7.15 51.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.549 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 1' ' ' GLY . 84.0 t -86.63 -42.06 15.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.778 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.88 -27.97 62.22 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.606 178.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 57.1 p -72.64 -19.63 61.41 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.481 HD11 HG11 ' B' ' 52' ' ' VAL . 57.9 tp -78.96 -24.13 44.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.354 178.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.778 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -65.82 -47.69 74.19 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.6 OUTLIER -65.37 -42.19 92.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.95 179.54 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -62.04 -34.32 76.02 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 121.374 0.607 . . . . 0.0 110.141 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.492 HG11 HD11 ' C' ' 88' ' ' LEU . 1.2 t -77.46 -31.61 17.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.299 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 51.5 mt-10 -66.88 -30.41 70.57 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -53.1 27.98 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.331 -1.304 . . . . 0.0 110.316 178.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.506 ' O ' HG23 ' A' ' 19' ' ' VAL . 74.7 mt -58.8 -34.21 71.23 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.151 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -66.63 -46.86 74.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.502 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.512 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.06 -31.9 74.2 Favored Glycine 0 C--O 1.237 0.288 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.54 178.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 75.0 mt-30 -71.3 -46.88 59.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.839 0.352 . . . . 0.0 110.745 179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 15' ' ' LEU . 89.5 t -64.46 -42.36 95.03 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 2.4 pt20 -62.36 -42.71 99.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.391 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.422 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 4.6 p-80 -78.01 -16.65 57.92 Favored 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 119.843 -0.743 . . . . 0.0 110.966 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.2 mt -72.0 -41.96 66.99 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.615 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -66.4 -36.12 82.04 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 177.369 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.46 -54.9 40.31 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.887 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.05 -41.86 93.21 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.367 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.507 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 4.3 m-85 -53.7 -32.17 50.85 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.646 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.9 t -49.71 -30.53 9.44 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.446 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 13.3 mm100 -91.62 -42.24 10.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.603 179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.6 m-85 -73.33 -20.42 60.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.968 0.413 . . . . 0.0 111.37 -179.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.534 ' HD2' ' O ' ' A' ' 30' ' ' LYS . 0.4 OUTLIER -63.23 -32.85 74.35 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.265 179.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -104.14 23.91 12.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.396 0.617 . . . . 0.0 110.548 178.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -93.74 -23.34 5.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.589 -179.632 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.474 ' HG2' ' H ' ' A' ' 34' ' ' LEU . 72.8 tt0 -81.22 -126.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.544 HD11 ' HA ' ' A' ' 31' ' ' LYS . 3.0 mt 62.45 -75.42 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.696 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 5.7 m-85 -53.7 -59.27 10.03 Favored Pre-proline 0 C--N 1.318 -0.793 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.494 -178.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.696 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 63.4 Cg_endo -78.13 176.12 10.33 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.953 1.769 . . . . 0.0 112.639 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -102.96 -89.23 0.39 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.476 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.467 ' HA3' ' HD3' ' C' ' 111' ' ' LYS . . . 103.36 18.38 14.89 Favored Glycine 0 C--N 1.329 0.191 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.632 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -107.06 -54.54 0.66 Allowed Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.94 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.2 tt . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.414 -0.803 . . . . 0.0 110.191 179.548 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.517 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.983 0 N-CA-C 112.781 -0.128 . . . . 0.0 112.781 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.541 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 3.5 mm? -52.13 -56.69 19.61 Favored Pre-proline 0 N--CA 1.473 0.697 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.541 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 9.2 Cg_endo -52.05 -37.11 67.75 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.21 2.607 . . . . 0.0 112.505 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -74.13 -8.07 54.85 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.489 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.517 HG23 ' O ' ' B' ' 41' ' ' GLY . 86.8 t -85.7 -41.99 15.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.802 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.88 -27.1 61.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.882 178.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.68 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 49.6 p -73.92 -19.18 60.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.515 HD11 HG11 ' C' ' 92' ' ' VAL . 56.3 tp -78.89 -22.93 45.21 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.239 177.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.802 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -67.07 -47.66 70.61 Favored 'General case' 0 CA--C 1.515 -0.399 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 178.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.7 OUTLIER -64.88 -43.07 94.11 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.774 179.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -61.23 -34.42 75.09 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 121.609 0.719 . . . . 0.0 110.395 179.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.481 HG11 HD11 ' A' ' 8' ' ' LEU . 1.1 t -78.08 -30.42 16.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.366 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 51.6 mt-10 -68.06 -29.52 68.51 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 177.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.18 -53.08 21.88 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.9 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.495 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -58.56 -34.03 70.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.194 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -67.02 -46.89 73.1 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.655 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.537 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.89 -32.05 73.86 Favored Glycine 0 C--O 1.236 0.269 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.478 178.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 74.5 mt-30 -70.96 -47.55 58.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.493 -0.354 . . . . 0.0 110.764 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 55' ' ' LEU . 94.9 t -64.11 -41.85 93.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 2.5 pt20 -62.51 -43.31 99.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.742 -0.208 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.412 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -77.31 -16.67 58.84 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.1 mt -72.01 -41.97 66.94 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 177.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.651 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -66.38 -36.48 82.96 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.17 -55.42 33.38 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.665 178.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.734 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.25 -42.07 90.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.51 178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 4.3 m-85 -53.86 -32.7 53.99 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.658 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 47.7 t -48.17 -32.91 7.64 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.068 0.461 . . . . 0.0 111.054 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.448 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 12.8 mm100 -89.63 -41.86 11.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.871 0.367 . . . . 0.0 111.894 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.734 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 41.0 m-85 -72.76 -21.8 60.96 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.056 0.455 . . . . 0.0 111.548 -179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.492 ' HD2' ' O ' ' B' ' 70' ' ' LYS . 0.4 OUTLIER -62.36 -33.63 75.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.187 179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.571 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -103.47 23.61 12.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.465 0.65 . . . . 0.0 110.544 178.399 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -93.27 -23.29 5.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.485 -179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.489 ' O ' ' HD1' ' B' ' 75' ' ' PHE . 71.9 tt0 -81.28 -127.01 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 178.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.571 HD11 ' HA ' ' B' ' 71' ' ' LYS . 2.7 mt 62.07 -74.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 176.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.688 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 3.5 m-85 -54.24 -58.14 15.14 Favored Pre-proline 0 C--N 1.316 -0.857 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.647 -178.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.688 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 66.5 Cg_endo -78.76 175.44 10.99 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 121.991 1.794 . . . . 0.0 112.726 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -102.57 -89.39 0.38 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.712 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . 0.491 ' HA3' ' HD3' ' A' ' 31' ' ' LYS . . . 103.94 18.79 12.95 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.865 179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.66 -55.56 0.62 Allowed Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.614 -0.803 . . . . 0.0 111.788 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.8 tt . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.165 179.447 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.521 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.844 0 CA-C-O 120.508 -0.051 . . . . 0.0 113.182 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.529 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 3.5 mm? -51.77 -56.76 18.42 Favored Pre-proline 0 N--CA 1.468 0.425 0 C-N-CA 123.218 0.607 . . . . 0.0 112.618 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 6.9 Cg_endo -51.14 -39.45 61.15 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 123.37 2.714 . . . . 0.0 112.254 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -71.56 -10.63 60.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.517 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.521 HG23 ' O ' ' C' ' 81' ' ' GLY . 86.4 t -83.46 -42.28 17.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.818 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -73.1 -27.34 61.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.855 179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 53.8 p -73.13 -19.26 61.17 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.492 HD11 HG11 ' A' ' 12' ' ' VAL . 55.8 tp -79.19 -23.22 43.99 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.693 -1.14 . . . . 0.0 109.468 177.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.818 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.6 OUTLIER -66.67 -47.67 71.74 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.6 OUTLIER -65.23 -42.9 92.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.85 179.277 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -61.2 -34.94 75.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.5 0.667 . . . . 0.0 110.249 179.096 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.515 HG11 HD11 ' B' ' 48' ' ' LEU . 1.1 t -77.14 -30.88 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.389 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 53.0 mt-10 -68.1 -30.54 69.74 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.39 -53.1 32.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.455 -1.248 . . . . 0.0 110.172 178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.509 ' O ' HG23 ' C' ' 99' ' ' VAL . 70.9 mt -59.02 -34.04 71.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.214 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -67.02 -46.68 73.72 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.691 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.517 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -60.08 -32.12 74.94 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 111.357 -0.697 . . . . 0.0 111.357 178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.732 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 74.6 mt-30 -70.78 -47.58 58.8 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-O 120.886 0.374 . . . . 0.0 110.775 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.509 HG23 ' O ' ' C' ' 95' ' ' LEU . 87.8 t -64.01 -41.68 93.28 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 -179.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.517 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 2.5 pt20 -63.16 -42.38 99.41 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 -179.229 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.415 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 5.1 p-80 -78.14 -16.99 57.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.809 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.732 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 10.5 mt -71.35 -41.51 69.67 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.634 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -66.65 -36.8 83.43 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -55.68 -54.7 41.01 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.665 178.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.61 -42.07 96.06 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.393 179.062 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 4.4 m-85 -53.73 -31.75 49.48 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.655 179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.5 t -49.77 -32.19 13.28 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.419 ' O ' ' HE3' ' C' ' 111' ' ' LYS . 13.1 mm100 -89.47 -43.16 11.04 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.642 179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 38.0 m-85 -72.7 -20.76 61.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.069 0.461 . . . . 0.0 111.409 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.571 ' O ' ' HD2' ' C' ' 110' ' ' LYS . 0.4 OUTLIER -62.48 -29.54 70.61 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.533 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.467 ' HD3' ' HA3' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -106.22 19.88 19.83 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.074 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.679 HG22 ' O ' ' C' ' 109' ' ' TYR . 34.7 m -92.17 -19.14 7.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 C-N-CA 119.373 -0.931 . . . . 0.0 110.312 177.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.584 ' O ' ' HD2' ' C' ' 116' ' ' PRO . 65.7 tt0 -76.46 -124.41 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 178.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 59.88 -84.85 0.02 OUTLIER 'General case' 0 C--N 1.338 0.098 0 CA-C-O 121.765 0.793 . . . . 0.0 112.6 177.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.714 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 2.8 m-85 -46.17 -60.7 3.26 Favored Pre-proline 0 CA--C 1.54 0.583 0 CA-C-N 113.588 -1.642 . . . . 0.0 113.432 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 70.3 Cg_endo -77.55 175.36 11.36 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 122.113 1.875 . . . . 0.0 112.847 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -102.74 -89.07 0.39 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.273 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . 0.433 ' HA3' ' HD3' ' B' ' 71' ' ' LYS . . . 103.36 17.95 16.15 Favored Glycine 0 C--N 1.329 0.194 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.593 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -106.12 -56.83 0.65 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.724 -0.751 . . . . 0.0 111.801 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 8.5 tt . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.251 -0.88 . . . . 0.0 109.842 179.36 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.459 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.851 -0.499 . . . . 0.0 111.851 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.475 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 6.9 mp -55.45 -55.41 40.3 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 119.383 -0.341 . . . . 0.0 111.69 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.475 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 50.6 Cg_exo -44.88 -43.29 15.24 Favored 'Trans proline' 0 C--N 1.359 1.093 0 C-N-CA 122.94 2.427 . . . . 0.0 112.768 -179.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -62.92 -39.69 95.33 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.022 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 1' ' ' GLY . 60.3 t -59.67 -46.05 93.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.896 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.72 -26.67 62.58 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.967 0.413 . . . . 0.0 110.551 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 65.1 m -70.89 -19.29 62.63 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.851 0.834 . . . . 0.0 108.995 177.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.437 HD11 HG11 ' B' ' 52' ' ' VAL . 67.6 tp -76.64 -23.69 53.32 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.781 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.641 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 1.6 mmt85 -67.98 -32.63 73.18 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -70.87 -47.82 57.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.734 179.596 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.518 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 39.5 tt0 -63.25 -32.36 73.75 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.838 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.633 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.1 p -77.02 -32.52 19.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.109 -179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 44.0 mt-10 -70.78 -27.36 63.86 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.81 -53.69 20.17 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 114.48 -1.237 . . . . 0.0 109.288 178.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 77.0 mt -57.62 -33.33 68.13 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.384 178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.457 ' HA ' HG12 ' A' ' 19' ' ' VAL . 17.8 tt0 -69.75 -44.35 70.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.8 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -60.99 -31.52 76.78 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.612 178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.741 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -73.77 -46.83 43.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.286 179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.457 HG12 ' HA ' ' A' ' 16' ' ' GLN . 13.4 p -69.86 -31.09 46.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.749 -178.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -71.42 -40.47 70.42 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.171 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.1 p-80 -79.77 -18.65 50.53 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.888 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.741 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 10.5 mt -73.37 -39.45 65.14 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 176.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.746 ' HG3' HD11 ' C' ' 102' ' ' LEU . 37.5 tt0 -65.99 -41.36 91.18 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.326 177.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.67 -46.79 74.1 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.263 178.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.713 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.81 -38.13 89.95 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 114.876 -1.057 . . . . 0.0 110.437 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.758 ' HB3' ' HG3' ' A' ' 30' ' ' LYS . 3.8 m-85 -59.24 -20.52 54.82 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.7 t -55.31 -23.68 24.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.099 0.476 . . . . 0.0 110.589 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.507 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 4.8 mm100 -107.83 -20.85 13.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.015 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.713 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 27.8 m-85 -96.08 -17.25 21.05 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.758 ' HG3' ' HB3' ' A' ' 26' ' ' PHE . 73.6 mttt -68.42 -29.83 68.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.829 0.347 . . . . 0.0 110.351 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HD3' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -102.32 26.71 7.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.057 0.456 . . . . 0.0 110.303 178.222 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.664 HG23 ' HA ' ' A' ' 29' ' ' TYR . 5.1 t -87.37 -42.87 15.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.464 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 10.6 tt0 -99.86 105.35 17.09 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 122.224 1.012 . . . . 0.0 111.075 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.894 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -177.71 -36.22 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.471 0 CA-C-N 112.718 -2.037 . . . . 0.0 110.618 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.894 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -121.82 -0.3 0.07 OUTLIER Pre-proline 0 CA--C 1.557 1.233 0 N-CA-C 115.968 1.84 . . . . 0.0 115.968 179.563 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.665 ' HD3' ' H ' ' A' ' 35' ' ' PHE . 31.9 Cg_exo -65.51 -172.39 0.24 Allowed 'Trans proline' 0 C--N 1.371 1.749 0 CA-C-N 122.468 1.917 . . . . 0.0 114.268 -178.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.454 ' OD1' ' HA ' ' C' ' 116' ' ' PRO . 17.7 p-10 -100.32 -161.79 0.89 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.955 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 144.86 -157.19 27.22 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.092 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -110.63 66.61 0.23 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.529 -0.844 . . . . 0.0 111.776 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.7 tp . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.723 -179.368 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.437 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.815 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.497 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 6.8 mp -55.96 -55.6 39.56 Favored Pre-proline 0 N--CA 1.468 0.437 0 CA-C-O 119.11 -0.471 . . . . 0.0 112.026 179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.497 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 53.6 Cg_exo -44.45 -43.78 13.71 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 122.735 2.29 . . . . 0.0 112.77 -179.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -62.41 -39.66 94.0 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.066 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.437 HG23 ' O ' ' B' ' 41' ' ' GLY . 57.4 t -59.94 -45.49 95.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.992 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.626 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.21 -26.11 61.91 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.53 179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.517 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 57.6 m -71.09 -18.94 62.51 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.873 0.844 . . . . 0.0 108.982 177.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.431 HD11 HG11 ' C' ' 92' ' ' VAL . 69.8 tp -76.98 -23.76 52.27 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.877 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 1.7 mmt85 -67.99 -32.57 73.06 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.517 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.1 OUTLIER -70.84 -49.11 49.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.747 179.668 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.545 ' O ' ' HG ' ' B' ' 55' ' ' LEU . 39.7 tt0 -62.42 -31.69 72.43 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.956 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.602 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -77.56 -32.35 18.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.265 -178.804 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 44.1 mt-10 -70.9 -27.67 63.96 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 177.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -68.35 -53.98 20.41 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.258 178.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 78.5 mt -57.87 -32.6 67.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.372 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.432 ' HA ' HG12 ' B' ' 59' ' ' VAL . 16.7 tt0 -70.41 -44.83 67.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.688 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.403 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.0 -31.12 75.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.476 179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.5 OUTLIER -73.72 -46.56 45.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.729 0.3 . . . . 0.0 111.489 179.37 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.432 HG12 ' HA ' ' B' ' 56' ' ' GLN . 13.2 p -70.21 -30.94 45.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.641 -178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.403 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 19.1 pt20 -71.42 -40.86 70.18 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.151 -0.22 . . . . 0.0 110.828 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.531 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.0 p-80 -79.34 -19.11 51.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.656 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 10.9 mt -73.25 -39.72 65.2 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 176.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.564 ' HG3' HD21 ' A' ' 22' ' ' LEU . 37.7 tt0 -65.35 -42.18 93.1 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.1 -46.75 72.17 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.46 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.727 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.393 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.752 ' HB3' ' HG3' ' B' ' 70' ' ' LYS . 3.6 m-85 -58.49 -20.91 49.52 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.66 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 39.9 t -54.12 -25.61 23.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.054 0.454 . . . . 0.0 110.495 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.542 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 4.5 mm100 -106.51 -20.91 13.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.2 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.727 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 26.7 m-85 -95.75 -17.56 21.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.752 ' HG3' ' HB3' ' B' ' 66' ' ' PHE . 73.4 mttt -68.27 -30.24 69.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.076 0.465 . . . . 0.0 110.632 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.488 ' HB2' ' HE3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -101.88 26.61 7.31 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.298 0.571 . . . . 0.0 110.465 178.426 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.633 HG23 ' HA ' ' B' ' 69' ' ' TYR . 5.0 t -87.63 -42.44 15.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.645 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.507 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 12.4 tt0 -100.62 103.66 14.96 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-O 122.13 0.967 . . . . 0.0 111.339 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.83 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -176.28 -33.13 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 112.68 -2.055 . . . . 0.0 110.822 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.83 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.1 OUTLIER -124.47 0.32 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.164 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.716 ' HD3' ' H ' ' B' ' 75' ' ' PHE . 37.6 Cg_exo -65.63 -172.11 0.23 Allowed 'Trans proline' 0 C--N 1.369 1.63 0 CA-C-N 122.372 1.883 . . . . 0.0 114.476 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . 0.541 ' OD1' ' HA ' ' A' ' 36' ' ' PRO . 17.1 p-10 -100.47 -161.35 0.86 Allowed 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 114.358 -1.292 . . . . 0.0 110.997 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.61 -160.43 27.68 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.037 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -108.66 69.14 0.21 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.248 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 7.9 tp . . . . . 0 C--O 1.244 0.796 0 CA-C-O 118.435 -0.793 . . . . 0.0 110.602 -179.63 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.457 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.852 0 N-CA-C 111.838 -0.505 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.487 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 6.8 mp -56.54 -54.98 47.68 Favored Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 117.014 0.407 . . . . 0.0 111.656 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.487 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 51.5 Cg_exo -44.44 -42.95 14.02 Favored 'Trans proline' 0 C--N 1.363 1.308 0 C-N-CA 122.712 2.275 . . . . 0.0 112.881 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -63.85 -40.04 95.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.027 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.457 HG23 ' O ' ' C' ' 81' ' ' GLY . 64.8 t -58.95 -46.72 91.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.916 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.611 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -71.51 -26.05 62.51 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.837 0.351 . . . . 0.0 111.001 179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.526 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 67.2 m -71.82 -18.5 62.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.893 0.854 . . . . 0.0 108.849 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.467 HD11 HG11 ' A' ' 12' ' ' VAL . 65.6 tp -77.08 -23.25 51.93 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.634 179.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.645 ' O ' HG12 ' C' ' 92' ' ' VAL . 1.9 mmt85 -67.99 -32.51 72.96 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -71.29 -48.14 52.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.026 179.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.541 ' O ' ' HG ' ' C' ' 95' ' ' LEU . 38.7 tt0 -63.3 -31.77 73.01 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.583 179.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.645 HG12 ' O ' ' C' ' 89' ' ' ARG . 1.1 p -77.29 -32.7 19.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.263 -179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 43.9 mt-10 -70.95 -26.26 63.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.2 -53.79 18.14 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.173 178.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' C' ' 91' ' ' GLN . 75.5 mt -57.91 -32.77 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.426 -1.261 . . . . 0.0 110.423 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.439 ' O ' ' HG2' ' C' ' 100' ' ' GLN . 16.9 tt0 -69.68 -44.84 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.623 179.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.472 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -60.61 -31.3 74.51 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.748 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.623 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 0.5 OUTLIER -74.72 -44.94 47.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.692 0.282 . . . . 0.0 111.509 179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' C' ' 96' ' ' GLN . 13.5 p -71.34 -30.51 40.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 C-N-CA 120.609 -0.436 . . . . 0.0 111.453 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.472 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.2 pt20 -71.64 -42.2 67.89 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.862 -0.335 . . . . 0.0 111.157 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.623 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 10.5 p-80 -77.48 -19.03 56.54 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.902 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.746 HD11 ' HG3' ' A' ' 23' ' ' GLN . 1.5 mp -73.89 -39.45 63.9 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.532 ' HG3' HD21 ' B' ' 62' ' ' LEU . 38.2 tt0 -66.62 -41.46 88.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 176.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.03 71.72 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.421 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.739 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.33 -39.07 93.54 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.455 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.756 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 3.5 m-85 -58.58 -20.28 45.59 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 40.4 t -54.6 -25.67 27.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.212 0.529 . . . . 0.0 110.245 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.535 ' O ' ' HD3' ' C' ' 111' ' ' LYS . 4.7 mm100 -105.54 -22.82 12.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.085 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.739 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 25.8 m-85 -93.75 -17.83 22.73 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.756 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 74.2 mttt -68.01 -28.54 67.5 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.021 0.439 . . . . 0.0 110.619 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.05 26.52 8.64 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.223 0.535 . . . . 0.0 110.327 178.385 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.673 HG23 ' HA ' ' C' ' 109' ' ' TYR . 4.6 t -87.09 -42.66 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.214 179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.542 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 7.4 tt0 -99.95 104.77 16.42 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 122.043 0.925 . . . . 0.0 111.342 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.852 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -177.74 -33.81 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 112.964 -1.926 . . . . 0.0 111.034 -179.648 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.852 ' H ' HD23 ' C' ' 114' ' ' LEU . 0.1 OUTLIER -124.09 0.6 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.167 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.709 ' HD3' ' H ' ' C' ' 115' ' ' PHE . 42.2 Cg_exo -65.52 -168.46 0.12 Allowed 'Trans proline' 0 C--N 1.37 1.675 0 CA-C-N 122.337 1.871 . . . . 0.0 114.183 -178.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . 0.486 ' OD1' ' HA ' ' B' ' 76' ' ' PRO . 17.1 p-10 -104.62 -162.13 0.87 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.856 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 146.19 -155.53 26.56 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.076 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -113.72 67.09 0.26 Allowed Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.516 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 7.8 tp . . . . . 0 C--O 1.245 0.856 0 CA-C-O 118.463 -0.779 . . . . 0.0 110.424 -179.498 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.437 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 2.01 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.534 ' HB3' ' HD3' ' A' ' 3' ' ' PRO . 2.3 tm? -63.82 -53.11 52.51 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 122.756 0.422 . . . . 0.0 110.787 179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 2' ' ' LEU . 71.6 Cg_exo -43.89 -44.97 11.69 Favored 'Trans proline' 0 C--N 1.356 0.964 0 C-N-CA 122.914 2.41 . . . . 0.0 113.213 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.45 -32.18 73.55 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.938 -179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.701 HG22 HG11 ' B' ' 45' ' ' VAL . 82.7 t -63.01 -44.18 99.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.064 179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.684 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -66.68 -37.52 84.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.785 0.326 . . . . 0.0 110.521 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.716 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 41.1 m -63.32 -26.35 68.72 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.834 0.826 . . . . 0.0 109.154 178.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 12' ' ' VAL . 62.5 tp -74.21 -39.87 62.83 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.255 178.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.684 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -55.86 -44.4 78.03 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 179.648 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.716 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -63.8 -42.15 97.76 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.757 179.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.7 tt0 -63.22 -34.8 78.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.989 0.423 . . . . 0.0 110.738 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 8' ' ' LEU . 54.5 t -70.07 -40.63 78.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.577 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.484 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 32.5 tt0 -63.3 -32.02 73.32 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.49 -61.42 2.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.549 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.7 mm? -60.27 -31.41 70.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.503 -1.226 . . . . 0.0 112.485 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.547 ' HA ' HG12 ' A' ' 19' ' ' VAL . 14.4 pt20 -74.16 -28.61 61.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -67.0 -33.55 84.16 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 178.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.72 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.9 mm100 -71.09 -50.5 33.1 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.334 -0.433 . . . . 0.0 111.102 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.547 HG12 ' HA ' ' A' ' 16' ' ' GLN . 8.4 p -66.8 -33.52 63.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.362 -0.535 . . . . 0.0 111.995 -179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.58 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -66.11 -43.17 87.99 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.96 -179.938 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -76.97 -19.71 56.99 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 119.703 -0.799 . . . . 0.0 110.208 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.771 HD21 ' HG2' ' B' ' 63' ' ' GLN . 24.6 mt -71.01 -42.72 69.22 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' C' ' 102' ' ' LEU . 5.8 tm0? -70.19 -33.49 71.8 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 178.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.89 -62.46 1.73 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.48 178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.709 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.85 -42.61 98.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.863 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.74 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.1 OUTLIER -57.0 -25.98 59.45 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.705 -179.423 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -53.75 -28.59 35.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.267 0.556 . . . . 0.0 110.207 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' B' ' 73' ' ' GLU . 14.1 mt-30 -90.75 -50.29 5.99 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.893 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.709 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 19.5 m-85 -66.58 -17.81 65.02 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -177.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -70.86 -20.71 62.5 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 110.782 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.56 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -107.25 35.52 3.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.592 0.71 . . . . 0.0 109.495 178.333 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.506 HG23 ' HA ' ' A' ' 29' ' ' TYR . 15.5 t -98.65 -35.64 5.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.805 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.549 ' OE1' ' HB3' ' C' ' 108' ' ' GLN . 40.3 tt0 -88.19 89.76 8.12 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 122.861 1.315 . . . . 0.0 110.934 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.632 HD12 ' H ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -167.92 -36.66 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 111.983 -2.371 . . . . 0.0 109.068 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.715 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 59.2 m-85 -56.51 -55.55 41.56 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.291 178.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.715 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 93.3 Cg_endo -82.73 178.61 5.93 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.248 1.965 . . . . 0.0 111.241 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.7 t30 -89.3 -55.75 3.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.749 0.309 . . . . 0.0 111.47 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.66 -108.58 3.07 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.845 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.78 -63.98 4.38 Favored Glycine 0 C--N 1.328 0.094 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.676 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.246 0.874 0 CA-C-O 118.73 -0.652 . . . . 0.0 111.143 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.441 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.295 -0.322 . . . . 0.0 112.295 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.545 ' HB3' ' HD3' ' B' ' 43' ' ' PRO . 2.4 tm? -63.79 -53.32 51.03 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-O 119.209 -0.424 . . . . 0.0 110.733 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' B' ' 42' ' ' LEU . 77.2 Cg_exo -43.67 -45.34 10.91 Favored 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 122.626 2.217 . . . . 0.0 113.242 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -63.06 -31.03 72.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.232 -179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.701 HG11 HG22 ' A' ' 5' ' ' VAL . 83.7 t -64.05 -44.43 97.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.942 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.678 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -66.34 -38.38 87.51 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.871 0.367 . . . . 0.0 110.53 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.667 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.0 m -63.8 -23.91 67.55 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.803 0.811 . . . . 0.0 109.548 177.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.795 ' O ' HG23 ' B' ' 52' ' ' VAL . 65.0 tp -76.04 -39.35 55.79 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.678 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -56.01 -44.2 78.45 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 179.51 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.667 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -64.21 -42.88 96.41 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.565 179.575 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.45 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 37.0 tt0 -62.04 -35.08 77.53 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.034 0.445 . . . . 0.0 110.787 178.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.795 HG23 ' O ' ' B' ' 48' ' ' LEU . 57.9 t -70.44 -40.11 77.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.607 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.524 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 32.9 tt0 -63.39 -32.05 73.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.8 0.809 . . . . 0.0 109.006 179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.53 -61.19 2.36 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.377 -1.283 . . . . 0.0 110.588 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' B' ' 55' ' ' LEU . 2.6 mm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.353 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.532 ' HA ' HG12 ' B' ' 59' ' ' VAL . 14.1 pt20 -73.94 -28.78 61.68 Favored 'General case' 0 C--O 1.222 -0.395 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.577 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -67.25 -33.25 82.14 Favored Glycine 0 C--N 1.335 0.477 0 C-N-CA 119.909 -1.138 . . . . 0.0 110.506 178.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.723 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.8 mm-40 -71.42 -49.66 39.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.547 -0.326 . . . . 0.0 111.263 179.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.8 p -67.56 -33.06 59.85 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.959 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -66.06 -44.36 84.78 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.899 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 4.3 p-80 -76.01 -19.93 58.25 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.408 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.723 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 23.0 mt -71.28 -42.31 68.9 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.771 ' HG2' HD21 ' A' ' 22' ' ' LEU . 5.8 tm0? -69.98 -34.67 73.67 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.3 -61.94 2.05 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.459 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.68 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.16 -42.78 99.17 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.666 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.745 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.1 OUTLIER -56.67 -26.15 55.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.195 -179.509 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 24.9 t -54.1 -27.9 35.89 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.272 0.558 . . . . 0.0 110.325 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.599 ' HB3' ' OE1' ' C' ' 113' ' ' GLU . 14.3 mt-30 -90.87 -51.0 5.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.592 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.68 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 17.4 m-85 -65.72 -17.83 64.89 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 pptp? -71.41 -20.64 62.1 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.979 0.419 . . . . 0.0 110.756 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.556 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -107.17 36.07 2.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 122.135 0.969 . . . . 0.0 109.181 178.074 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.495 HG23 ' HA ' ' B' ' 69' ' ' TYR . 15.6 t -99.56 -35.01 4.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.72 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 46.5 tt0 -88.85 89.12 7.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 122.869 1.319 . . . . 0.0 111.029 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.639 HD12 ' H ' ' B' ' 75' ' ' PHE . 0.2 OUTLIER -167.72 -36.06 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 111.713 -2.494 . . . . 0.0 109.256 -179.807 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.709 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 57.5 m-85 -56.9 -55.48 43.22 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.327 178.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 87.5 Cg_endo -82.15 -177.82 3.72 Favored 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 122.273 1.982 . . . . 0.0 111.194 178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 42.1 t30 -92.89 -56.26 3.06 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.114 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 84.35 -107.62 3.02 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.644 -0.788 . . . . 0.0 111.613 -179.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 82.74 -64.69 4.26 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.705 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.1 pp . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.5 -179.858 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.12 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.496 ' HB3' ' HD3' ' C' ' 83' ' ' PRO . 6.8 tp -63.61 -52.18 60.94 Favored Pre-proline 0 N--CA 1.445 -0.691 0 CA-C-N 117.431 0.615 . . . . 0.0 112.399 179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.496 ' HD3' ' HB3' ' C' ' 82' ' ' LEU . 73.1 Cg_exo -43.06 -44.2 9.57 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 122.675 2.25 . . . . 0.0 112.67 -178.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -62.98 -32.59 73.96 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.063 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.668 HG22 HG11 ' A' ' 5' ' ' VAL . 89.5 t -62.9 -44.48 99.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.118 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.609 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -66.81 -38.35 86.32 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.401 . . . . 0.0 110.166 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 20.9 m -62.78 -26.31 68.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.883 0.849 . . . . 0.0 109.287 178.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.691 ' O ' HG12 ' C' ' 92' ' ' VAL . 63.5 tp -73.09 -42.1 63.34 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.004 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.675 ' HB3' HH11 ' C' ' 89' ' ' ARG . 0.0 OUTLIER -55.82 -43.82 77.31 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.952 0.342 . . . . 0.0 110.637 -179.941 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -63.48 -41.74 98.57 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.031 179.344 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -63.0 -36.77 84.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.953 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.691 HG12 ' O ' ' C' ' 88' ' ' LEU . 0.2 OUTLIER -74.8 -31.29 25.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.398 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.581 -179.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.535 ' O ' ' HG2' ' C' ' 96' ' ' GLN . 36.7 tt0 -65.34 -33.49 76.09 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 177.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.51 -58.85 4.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.596 -1.184 . . . . 0.0 110.657 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.481 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.3 mm? -60.97 -31.08 70.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.798 -1.092 . . . . 0.0 112.07 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' C' ' 99' ' ' VAL . 14.5 pt20 -74.28 -28.59 61.27 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.588 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -66.63 -34.11 86.51 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.157 -1.02 . . . . 0.0 110.619 178.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.744 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.5 mm-40 -70.62 -49.43 47.65 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 115.367 -0.416 . . . . 0.0 111.089 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.7 p -68.08 -32.74 57.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 C-N-CA 120.342 -0.543 . . . . 0.0 112.194 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.86 -43.21 84.2 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.681 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 4.6 p-80 -76.87 -19.69 57.17 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.013 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 23.6 mt -71.55 -41.95 68.45 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 178.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.7 ' HG2' HD21 ' B' ' 62' ' ' LEU . 6.3 tm0? -70.69 -34.21 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.39 -62.4 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.472 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.46 -42.49 96.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.664 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.705 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.1 OUTLIER -56.27 -28.26 58.02 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.705 -179.315 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.8 t -51.19 -29.93 15.49 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.133 0.492 . . . . 0.0 110.314 -179.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.549 ' HB3' ' OE1' ' A' ' 33' ' ' GLU . 13.6 mt-30 -89.82 -51.33 5.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.047 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 19.3 m-85 -66.34 -17.27 64.67 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -177.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.47 -19.37 62.22 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.984 0.421 . . . . 0.0 110.875 -178.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.491 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -109.08 35.7 3.16 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.812 0.815 . . . . 0.0 109.29 177.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.523 HG23 ' HA ' ' C' ' 109' ' ' TYR . 16.2 t -98.28 -36.08 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.835 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.599 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 43.1 tt0 -87.32 89.51 8.02 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 122.958 1.361 . . . . 0.0 111.039 178.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.633 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -167.39 -37.54 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.071 -2.331 . . . . 0.0 109.202 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.686 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 58.9 m-85 -56.03 -55.89 36.68 Favored Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.243 178.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.686 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 90.3 Cg_endo -81.85 -179.47 4.84 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.089 1.859 . . . . 0.0 111.286 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -91.18 -55.8 3.4 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.912 0.387 . . . . 0.0 111.283 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 83.95 -107.37 2.96 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.889 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 81.99 -65.59 4.03 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.621 179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.536 -0.745 . . . . 0.0 111.61 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.512 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.04 -0.424 . . . . 0.0 112.04 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.557 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 3.3 mm? -56.05 -55.11 45.15 Favored Pre-proline 0 N--CA 1.469 0.475 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.557 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 2.3 Cg_endo -50.62 -41.13 54.54 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 123.258 2.639 . . . . 0.0 112.624 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.24 -34.5 77.81 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.581 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 1' ' ' GLY . 96.7 t -61.14 -55.38 25.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.955 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.81 -33.46 75.73 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.112 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.4 m -66.95 -28.71 68.51 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.645 0.735 . . . . 0.0 109.792 178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 70.0 tp -73.28 -22.34 60.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.09 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HA ' HG22 ' A' ' 12' ' ' VAL . 25.8 mmm-85 -69.13 -23.59 63.99 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.3 OUTLIER -75.34 -40.2 58.55 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 179.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -72.07 -29.29 63.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.772 -1.103 . . . . 0.0 110.841 179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.727 HG22 ' HA ' ' A' ' 9' ' ' ARG . 27.6 m -76.05 -38.71 35.6 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.261 0 C-N-CA 120.294 -0.562 . . . . 0.0 111.296 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 95.7 mt-10 -70.06 -28.84 65.77 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 178.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.65 -60.85 2.79 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.015 177.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.552 ' O ' HG23 ' A' ' 19' ' ' VAL . 2.0 mm? -58.3 -39.43 79.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.911 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 17.0 pt20 -67.13 -28.1 67.86 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.738 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.664 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -66.66 -33.42 84.36 Favored Glycine 0 C--N 1.334 0.439 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 177.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.74 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 82.3 mt-30 -72.05 -40.42 68.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.718 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 15' ' ' LEU . 2.6 t -67.65 -39.9 83.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.963 179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.664 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.2 pt20 -62.18 -42.18 99.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.926 -178.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.437 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 5.9 p-80 -81.66 -16.79 50.24 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 119.44 -0.904 . . . . 0.0 111.56 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.74 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -74.01 -43.6 57.43 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 177.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.576 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.7 tm0? -68.07 -36.22 79.49 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.64 70.88 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.159 177.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.33 -43.91 95.99 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.581 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.649 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 1.8 m-85 -52.28 -30.17 26.68 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 123.489 0.493 . . . . 0.0 111.953 179.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.5 t -50.69 -31.92 17.81 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.984 0.421 . . . . 0.0 111.142 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.442 ' O ' ' HE2' ' A' ' 31' ' ' LYS . 97.1 mm-40 -89.57 -44.62 9.96 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.18 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.8 m-85 -65.21 -20.02 66.24 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.867 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -57.3 -26.11 60.36 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.526 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.23 32.39 4.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 122.012 0.91 . . . . 0.0 109.453 178.013 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.735 HG11 HG12 ' B' ' 72' ' ' VAL . 65.7 t -128.13 -24.48 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.029 -1.441 . . . . 0.0 110.55 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.855 ' HG3' ' H ' ' A' ' 34' ' ' LEU . 3.5 pt-20 -65.18 -63.8 1.02 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.718 0.77 . . . . 0.0 112.361 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.855 ' H ' ' HG3' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -46.4 -49.21 18.28 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.53 -1.668 . . . . 0.0 115.107 -177.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.619 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 21.4 m-30 -47.09 -68.03 0.34 Allowed Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.694 ' HG2' HG22 ' C' ' 112' ' ' VAL . 19.1 Cg_endo -64.51 176.82 2.51 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.516 2.144 . . . . 0.0 113.937 -178.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -165.21 153.1 11.33 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.046 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -65.74 133.02 34.81 Favored Glycine 0 C--N 1.331 0.275 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.447 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -170.67 -110.36 0.23 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.082 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 8.4 tp . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.406 -0.806 . . . . 0.0 110.431 -179.916 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.511 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.986 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.548 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 3.3 mm? -56.53 -54.8 49.53 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 2.7 Cg_endo -50.93 -40.14 58.48 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.166 2.578 . . . . 0.0 112.661 -178.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -63.37 -36.67 84.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.333 179.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.511 HG23 ' O ' ' B' ' 41' ' ' GLY . 96.4 t -59.07 -55.05 26.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.092 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.521 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.1 -33.71 76.39 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.327 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.9 m -67.17 -28.07 67.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.688 0.756 . . . . 0.0 109.594 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.1 tp -73.15 -23.03 60.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.101 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.737 ' HA ' HG22 ' B' ' 52' ' ' VAL . 24.1 mmm-85 -69.07 -23.16 64.0 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.5 OUTLIER -74.99 -40.53 60.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.596 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -72.01 -29.12 63.88 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.872 179.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.737 HG22 ' HA ' ' B' ' 49' ' ' ARG . 27.2 m -76.4 -38.59 32.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.3 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.206 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.568 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 92.6 mt-10 -70.34 -28.06 64.84 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.79 -60.72 2.76 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.196 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.584 HD12 HG11 ' C' ' 99' ' ' VAL . 2.1 mm? -58.26 -39.59 79.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.005 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.568 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.7 pt20 -66.92 -28.45 68.31 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.398 -179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -66.15 -33.65 85.91 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.713 178.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 82.4 mt-30 -71.78 -40.37 69.3 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.376 -0.412 . . . . 0.0 110.497 178.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' O ' ' B' ' 55' ' ' LEU . 2.5 t -67.99 -39.84 82.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.064 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.3 pt20 -61.53 -42.48 98.88 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.83 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 5.9 p-80 -81.51 -17.77 47.42 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.447 -179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 6.5 mt -72.73 -43.7 62.64 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 4.9 tm0? -68.36 -36.54 79.36 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.99 -50.63 70.31 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.589 177.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.737 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.36 -43.83 96.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.394 178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.598 ' HA ' ' HD2' ' B' ' 69' ' ' TYR . 1.5 m-85 -51.48 -30.67 20.78 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 123.692 0.62 . . . . 0.0 111.854 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 40.6 t -49.82 -33.47 16.81 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.837 0.351 . . . . 0.0 111.106 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' B' ' 71' ' ' LYS . 97.4 mm-40 -88.68 -44.4 10.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.492 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.737 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 46.1 m-85 -64.86 -20.5 66.45 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.771 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -57.47 -27.21 62.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.234 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -105.01 31.97 4.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.083 0.944 . . . . 0.0 109.351 178.34 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.735 HG12 HG11 ' A' ' 32' ' ' VAL . 64.6 t -127.83 -24.8 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.257 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.871 ' HG3' ' H ' ' B' ' 74' ' ' LEU . 3.4 pt-20 -64.44 -64.53 0.86 Allowed 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.663 0.744 . . . . 0.0 112.191 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.871 ' H ' ' HG3' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -45.62 -50.53 13.21 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 125.987 1.715 . . . . 0.0 115.271 -177.861 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.628 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 21.1 m-30 -46.39 -68.12 0.33 Allowed Pre-proline 0 N--CA 1.477 0.913 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.69 ' HG2' HG22 ' A' ' 32' ' ' VAL . 19.3 Cg_endo -64.23 177.72 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.598 2.198 . . . . 0.0 113.699 -178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -167.26 152.85 7.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.988 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.18 133.68 36.5 Favored Glycine 0 C--N 1.329 0.173 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.635 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.05 -110.04 0.23 Allowed Glycine 0 CA--C 1.51 -0.253 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.13 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.3 tp . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.013 179.554 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.511 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.569 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 3.3 mm? -56.24 -55.9 37.13 Favored Pre-proline 0 N--CA 1.468 0.427 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 5.3 Cg_endo -50.18 -40.67 51.26 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.538 2.825 . . . . 0.0 112.673 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -63.4 -34.72 78.34 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.446 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.511 HG23 ' O ' ' C' ' 81' ' ' GLY . 85.2 t -61.28 -54.86 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.982 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.576 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.76 -33.05 75.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.73 0.3 . . . . 0.0 111.129 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.7 m -66.86 -29.05 68.86 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.652 0.739 . . . . 0.0 109.489 178.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.438 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 70.2 tp -72.7 -22.77 60.85 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.86 179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.576 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 31.2 mmm-85 -66.32 -27.46 67.92 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.3 OUTLIER -73.02 -42.16 63.48 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.905 179.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -70.83 -27.37 63.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.662 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 0.8 OUTLIER -76.16 -42.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 CA-C-N 114.865 -1.061 . . . . 0.0 111.314 -178.374 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.578 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 94.2 mt-10 -70.97 -27.16 63.53 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.76 -61.08 2.53 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.257 -1.338 . . . . 0.0 110.079 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.557 ' O ' HG12 ' C' ' 99' ' ' VAL . 1.6 mm? -58.09 -37.97 75.52 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 114.15 -1.386 . . . . 0.0 111.95 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.578 ' HG2' ' HA ' ' C' ' 93' ' ' GLU . 16.5 pt20 -69.13 -27.74 65.84 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.611 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.672 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -66.63 -33.44 84.47 Favored Glycine 0 C--N 1.333 0.401 0 N-CA-C 110.525 -1.03 . . . . 0.0 110.525 178.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.45 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 83.5 mt-30 -72.52 -41.93 65.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.403 -0.399 . . . . 0.0 111.181 179.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.584 HG11 HD12 ' B' ' 55' ' ' LEU . 0.2 OUTLIER -72.38 -30.14 33.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.828 -179.399 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.672 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 15.0 pt20 -66.6 -43.33 85.15 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 121.106 -0.237 . . . . 0.0 110.503 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.45 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 8.3 p-80 -79.9 -16.67 54.88 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 119.939 -0.705 . . . . 0.0 111.433 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.649 ' HG ' ' CE2' ' A' ' 26' ' ' PHE . 1.3 mp -75.2 -42.39 55.72 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 178.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -69.05 -35.68 76.84 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.09 -50.67 70.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.673 177.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.21 -43.88 95.59 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.036 -0.983 . . . . 0.0 110.357 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.584 ' HA ' ' HD2' ' C' ' 109' ' ' TYR . 1.6 m-85 -52.14 -30.42 26.46 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.942 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.9 t -49.94 -33.78 18.6 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 120.979 0.419 . . . . 0.0 111.027 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.414 ' O ' ' HE2' ' C' ' 111' ' ' LYS . 97.1 mm-40 -87.46 -45.85 10.14 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.392 178.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.728 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 43.5 m-85 -64.28 -20.53 66.13 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.933 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -56.2 -28.0 56.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.112 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -105.23 32.07 4.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.947 0.879 . . . . 0.0 109.758 178.499 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.737 HG21 ' HA ' ' A' ' 33' ' ' GLU . 59.8 t -128.04 -23.96 1.45 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-N 114.2 -1.363 . . . . 0.0 110.479 -179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.807 ' HG3' ' H ' ' C' ' 114' ' ' LEU . 3.6 pt-20 -66.49 -60.44 2.73 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.875 0.845 . . . . 0.0 112.879 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.807 ' H ' ' HG3' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -50.69 -46.35 58.7 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 113.859 -1.519 . . . . 0.0 115.04 -177.282 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.57 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 21.3 m-30 -48.7 -67.58 0.41 Allowed Pre-proline 0 N--CA 1.473 0.707 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 -177.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.651 ' HG2' HG22 ' B' ' 72' ' ' VAL . 25.9 Cg_endo -65.61 176.89 3.12 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.522 2.148 . . . . 0.0 113.92 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -165.6 153.81 11.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.105 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -66.91 134.18 31.94 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.568 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -171.36 -111.12 0.25 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 8.5 tp . . . . . 0 C--O 1.248 0.977 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.873 179.104 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.421 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.911 0 CA-C-O 120.024 -0.32 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.586 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 6.7 mp -58.41 -56.84 31.28 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 119.255 -0.402 . . . . 0.0 111.381 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 81.6 Cg_exo -43.44 -45.49 10.28 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 122.879 2.386 . . . . 0.0 112.947 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -59.89 -41.76 92.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.207 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 1' ' ' GLY . 97.8 t -60.97 -51.31 74.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.799 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.44 -33.25 74.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.084 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.739 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 7.9 t -68.14 -20.8 64.93 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.673 HD11 HG21 ' B' ' 52' ' ' VAL . 59.2 tp -76.2 -28.14 57.14 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.152 178.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.642 ' HE ' HD13 ' C' ' 88' ' ' LEU . 23.6 mmm-85 -62.91 -43.67 98.16 Favored 'General case' 0 C--N 1.333 -0.152 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.739 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.49 -37.09 82.33 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.566 178.806 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 7' ' ' SER . 84.7 mt-30 -63.33 -33.77 76.26 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 121.529 0.68 . . . . 0.0 109.469 178.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.677 HG21 HD11 ' C' ' 88' ' ' LEU . 54.1 t -72.11 -35.08 52.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.421 -0.808 . . . . 0.0 110.469 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 97.7 mt-10 -66.35 -26.2 67.17 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.387 0.613 . . . . 0.0 109.545 177.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -69.43 -53.15 20.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.221 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.638 HD11 ' HA ' ' B' ' 56' ' ' GLN . 4.0 mm? -56.52 -35.31 67.91 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.461 178.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.649 ' HA ' HD11 ' C' ' 95' ' ' LEU . 21.6 tt0 -71.3 -43.43 67.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.152 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.425 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.59 -31.83 76.22 Favored Glycine 0 C--N 1.318 -0.467 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.871 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.579 ' HA ' ' CE1' ' A' ' 21' ' ' HIS . 58.9 mt-30 -75.27 -41.92 56.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.829 0.347 . . . . 0.0 111.167 179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.496 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.4 p -73.95 -27.4 22.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.59 -179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 17.8 pt20 -74.11 -40.01 62.97 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.183 -0.207 . . . . 0.0 110.571 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.579 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 8.3 p-80 -80.95 -19.9 43.17 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.602 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.724 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.8 mp -79.85 -33.99 39.68 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 120.247 -0.581 . . . . 0.0 109.642 178.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.701 ' HG2' HD11 ' C' ' 102' ' ' LEU . 4.4 tm0? -74.46 -30.2 61.77 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 106.676 -1.602 . . . . 0.0 106.676 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.3 -62.68 1.7 Allowed 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.004 -1.453 . . . . 0.0 109.775 177.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.66 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -58.41 -43.29 88.59 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.371 178.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.62 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -53.86 -32.06 51.75 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.074 -179.636 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 37.5 t -50.51 -33.92 23.3 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.991 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.712 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 8.7 mt-30 -82.7 -46.78 12.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.236 0.541 . . . . 0.0 110.981 179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.66 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 24.9 m-85 -71.29 -18.86 62.4 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.098 -178.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.417 ' HD3' ' O ' ' A' ' 30' ' ' LYS . 14.2 tmtt? -72.91 -25.71 61.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.752 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.712 ' HE2' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -106.73 29.49 6.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.724 0.773 . . . . 0.0 109.347 177.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.623 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 8.8 t -95.27 -36.79 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.01 179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.55 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 14.1 tt0 -95.2 101.05 12.77 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-O 122.744 1.259 . . . . 0.0 111.11 178.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.59 HD12 ' H ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -164.04 -39.9 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.781 0 CA-C-N 112.738 -2.028 . . . . 0.0 109.365 -179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.919 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 36.7 m-85 -66.63 -62.1 4.34 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.068 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.919 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 33.1 Cg_endo -91.64 -177.22 0.94 Allowed 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.955 2.436 . . . . 0.0 113.002 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.534 ' ND2' ' HB ' ' A' ' 40' ' ' ILE . 47.7 t30 -129.33 106.63 8.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.402 178.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -85.83 140.86 18.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.432 -0.89 . . . . 0.0 112.648 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 103.73 -48.15 1.04 Allowed Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.71 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.534 ' HB ' ' ND2' ' A' ' 37' ' ' ASN . 26.9 mt . . . . . 0 C--O 1.248 0.976 0 CA-C-O 118.768 -0.634 . . . . 0.0 110.514 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.454 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.834 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.603 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 6.9 mp -59.07 -58.13 21.83 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-O 119.439 -0.315 . . . . 0.0 111.054 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.603 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 73.0 Cg_exo -41.55 -46.53 6.08 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 123.517 2.811 . . . . 0.0 113.273 -179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.26 -42.85 96.2 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.915 -1.038 . . . . 0.0 110.864 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.454 HG23 ' O ' ' B' ' 41' ' ' GLY . 95.5 t -59.66 -51.0 77.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.729 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.546 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.56 -33.1 74.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.087 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.75 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 8.2 t -68.81 -20.29 64.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.528 0.68 . . . . 0.0 109.277 178.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.707 HD11 HG21 ' C' ' 92' ' ' VAL . 59.4 tp -76.0 -28.51 57.82 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.139 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.671 ' HE ' HD13 ' A' ' 8' ' ' LEU . 23.6 mmm-85 -62.88 -43.76 97.92 Favored 'General case' 0 CA--C 1.521 -0.155 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.75 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -67.73 -36.59 80.86 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.649 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 47' ' ' SER . 86.1 mt-30 -63.46 -33.54 75.78 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.547 0.689 . . . . 0.0 109.325 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.673 HG21 HD11 ' A' ' 8' ' ' LEU . 63.1 t -73.05 -34.68 46.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.128 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 96.7 mt-10 -66.17 -25.71 67.07 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.494 0.664 . . . . 0.0 109.241 178.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.06 -52.91 20.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.948 -1.024 . . . . 0.0 109.679 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.635 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.24 -34.82 68.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.265 179.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.638 ' HA ' HD11 ' A' ' 15' ' ' LEU . 21.5 tt0 -71.48 -43.14 67.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.216 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.419 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -60.6 -32.37 78.1 Favored Glycine 0 C--N 1.319 -0.415 0 C-N-CA 120.542 -0.837 . . . . 0.0 111.592 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.583 ' HA ' ' CE1' ' B' ' 61' ' ' HIS . 58.9 mt-30 -74.89 -41.63 59.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.824 0.345 . . . . 0.0 111.418 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.486 HG12 ' HA ' ' B' ' 56' ' ' GLN . 8.1 p -74.14 -26.73 21.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.586 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.419 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 17.2 pt20 -74.46 -40.8 61.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.156 -0.218 . . . . 0.0 110.563 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.583 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 8.5 p-80 -80.16 -19.89 46.12 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.665 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.71 HD11 ' HG2' ' C' ' 103' ' ' GLN . 1.8 mp -79.51 -34.16 41.49 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.23 -0.588 . . . . 0.0 109.644 178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.724 ' HG2' HD11 ' A' ' 22' ' ' LEU . 4.8 tm0? -74.34 -30.63 62.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.9 -63.17 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.025 -1.443 . . . . 0.0 109.751 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.641 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -57.24 -43.7 83.17 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.225 178.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.633 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -53.64 -32.64 52.23 Favored 'General case' 0 C--O 1.209 -1.057 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.012 -179.613 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.7 t -50.41 -32.58 18.05 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.855 0.36 . . . . 0.0 110.999 -179.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.753 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 8.2 mt-30 -84.31 -46.65 11.56 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.171 0.51 . . . . 0.0 110.883 179.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.641 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 22.8 m-85 -70.88 -19.11 62.65 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.031 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.452 ' O ' ' HD3' ' B' ' 70' ' ' LYS . 14.0 tmtt? -73.04 -24.78 60.76 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.981 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -107.53 29.65 7.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.952 0.882 . . . . 0.0 109.45 176.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.62 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 8.1 t -95.24 -37.56 7.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.107 178.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.534 ' C ' ' HG ' ' B' ' 74' ' ' LEU . 14.2 tt0 -95.11 99.94 11.84 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 111.06 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.602 HD12 ' H ' ' B' ' 75' ' ' PHE . 0.1 OUTLIER -162.2 -41.27 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 112.71 -2.041 . . . . 0.0 108.826 179.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.936 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 34.8 m-85 -64.83 -62.5 4.79 Favored Pre-proline 0 CA--C 1.535 0.385 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.425 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.936 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 41.5 Cg_endo -91.12 -174.39 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.745 0 C-N-CA 122.912 2.408 . . . . 0.0 112.641 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . 0.49 ' ND2' ' HB ' ' B' ' 80' ' ' ILE . 47.3 t30 -132.6 105.43 7.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.378 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.06 141.18 19.09 Favored Glycine 0 CA--C 1.511 -0.191 0 C-N-CA 120.474 -0.869 . . . . 0.0 112.805 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 104.28 -48.24 1.01 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.653 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.49 ' HB ' ' ND2' ' B' ' 77' ' ' ASN . 25.5 mt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.598 -0.715 . . . . 0.0 109.969 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.429 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.936 0 N-CA-C 112.29 -0.324 . . . . 0.0 112.29 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.611 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 6.8 mp -59.24 -56.7 33.41 Favored Pre-proline 0 CA--C 1.53 0.194 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.281 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 75.2 Cg_exo -43.76 -44.86 11.39 Favored 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 123.096 2.531 . . . . 0.0 113.187 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -60.91 -42.6 98.36 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.738 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.429 HG23 ' O ' ' C' ' 81' ' ' GLY . 86.2 t -60.03 -51.35 73.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.779 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.569 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.53 -32.31 73.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.772 0.32 . . . . 0.0 111.497 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.735 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 7.9 t -69.27 -20.61 63.92 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.639 0.733 . . . . 0.0 109.209 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.677 HD11 HG21 ' A' ' 12' ' ' VAL . 59.6 tp -75.78 -27.75 58.12 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.218 178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.672 ' HE ' HD13 ' B' ' 48' ' ' LEU . 23.4 mmm-85 -63.37 -43.6 97.19 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.735 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.5 -35.59 77.72 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.46 179.067 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' C' ' 87' ' ' SER . 85.4 mt-30 -64.07 -33.41 75.69 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.397 0.618 . . . . 0.0 109.376 178.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.707 HG21 HD11 ' B' ' 48' ' ' LEU . 54.8 t -72.54 -35.65 51.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.256 179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 96.6 mt-10 -65.24 -27.54 68.73 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -68.34 -53.08 26.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.854 178.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.649 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.4 -34.84 69.3 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.294 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.635 ' HA ' HD11 ' B' ' 55' ' ' LEU . 17.4 tt0 -71.12 -42.81 68.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.169 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.49 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.03 -31.67 77.46 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.69 -0.767 . . . . 0.0 111.86 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.612 ' HA ' ' CE1' ' C' ' 101' ' ' HIS . 57.9 mt-30 -75.41 -41.67 55.5 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.558 -0.378 . . . . 0.0 111.132 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -73.96 -27.15 21.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.488 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.49 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 15.6 pt20 -74.12 -41.68 61.22 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 121.11 -0.236 . . . . 0.0 110.505 179.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.612 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.6 p-80 -79.29 -19.98 49.13 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.596 -0.842 . . . . 0.0 110.841 179.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.701 HD11 ' HG2' ' A' ' 23' ' ' GLN . 1.8 mp -79.37 -34.68 41.77 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.71 ' HG2' HD11 ' B' ' 62' ' ' LEU . 4.3 tm0? -73.81 -31.3 63.17 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 177.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.48 -63.06 1.41 Allowed 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 113.893 -1.503 . . . . 0.0 109.678 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -57.82 -43.68 85.92 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.185 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.63 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -53.48 -32.34 49.72 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.251 -0.886 . . . . 0.0 112.384 -179.543 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 45.9 t -50.91 -33.95 26.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.164 0.507 . . . . 0.0 110.815 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.739 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 8.3 mt-30 -81.99 -46.95 13.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.178 0.514 . . . . 0.0 110.908 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.648 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 26.4 m-85 -70.68 -18.93 62.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.809 -0.632 . . . . 0.0 112.138 -178.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' C' ' 110' ' ' LYS . 14.3 tmtt? -73.38 -24.92 60.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.905 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.739 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -107.21 28.12 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.791 0.805 . . . . 0.0 109.39 176.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.625 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 7.8 t -94.08 -36.9 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.08 179.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.489 ' HB2' HG21 ' B' ' 72' ' ' VAL . 9.0 tt0 -96.39 102.42 14.21 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-O 122.651 1.215 . . . . 0.0 110.808 178.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.677 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -167.32 -32.83 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.933 0 CA-C-N 112.548 -2.115 . . . . 0.0 110.022 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.932 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 43.4 m-85 -71.32 -61.04 2.36 Favored Pre-proline 0 CA--C 1.536 0.411 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 177.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.932 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 41.7 Cg_endo -91.3 -174.01 0.6 Allowed 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.919 2.413 . . . . 0.0 112.57 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . 0.504 ' ND2' ' HB ' ' C' ' 120' ' ' ILE . 45.9 t30 -133.16 105.0 6.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.648 178.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -84.26 141.46 19.88 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.335 -0.936 . . . . 0.0 112.868 -179.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 103.28 -46.44 1.21 Allowed Glycine 0 C--N 1.329 0.143 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.721 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . 0.504 ' HB ' ' ND2' ' C' ' 117' ' ' ASN . 27.0 mt . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.068 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.987 0 N-CA-C 112.039 -0.424 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.503 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 1.1 mm? -57.36 -54.99 49.06 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 117.068 0.434 . . . . 0.0 111.019 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 70.9 Cg_exo -40.92 -46.96 4.95 Favored 'Trans proline' 0 C--N 1.362 1.256 0 C-N-CA 123.615 2.876 . . . . 0.0 113.754 -178.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -63.49 -49.0 75.32 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 58.5 t -61.96 -53.29 49.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.727 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -63.74 -30.4 71.5 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.622 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 44.4 t -63.96 -30.2 71.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.673 0.749 . . . . 0.0 109.293 178.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.585 ' O ' HG13 ' A' ' 12' ' ' VAL . 59.2 tp -73.32 -25.73 60.76 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.727 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -69.03 -21.57 64.11 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.622 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.7 mt-30 -75.62 -40.53 56.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -69.23 -26.24 64.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.283 178.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 8' ' ' LEU . 15.2 m -78.21 -33.84 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.263 0 C-N-CA 120.119 -0.632 . . . . 0.0 110.236 179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.507 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 62.7 mm-40 -65.52 -34.4 78.16 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.89 6.28 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.329 -1.305 . . . . 0.0 110.952 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.598 HD11 HG11 ' B' ' 59' ' ' VAL . 41.8 tp -59.06 -39.34 81.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.742 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.546 ' HA ' HG12 ' A' ' 19' ' ' VAL . 18.0 pt20 -70.08 -23.28 63.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.649 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -68.72 -31.17 72.93 Favored Glycine 0 C--O 1.239 0.428 0 C-N-CA 120.222 -0.99 . . . . 0.0 110.935 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.695 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.1 mm100 -73.27 -49.08 29.62 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.441 0.638 . . . . 0.0 110.629 179.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.588 HG11 HD11 ' C' ' 95' ' ' LEU . 7.7 p -70.02 -26.34 29.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 C-N-CA 120.226 -0.59 . . . . 0.0 112.027 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -71.66 -42.46 67.49 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 122.142 -0.349 . . . . 0.0 110.376 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.455 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.0 p-80 -76.2 -18.13 59.21 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 119.642 -0.823 . . . . 0.0 109.613 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 18.6 mt -74.08 -39.86 63.14 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.696 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -69.4 -34.23 74.19 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.086 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -54.78 -63.62 1.09 Allowed 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 114.75 -1.114 . . . . 0.0 110.289 177.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.557 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -59.18 -40.47 85.8 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.681 179.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.553 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -55.16 -30.82 60.64 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.112 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -58.17 -31.52 67.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.089 0.471 . . . . 0.0 110.678 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -88.56 -15.56 34.84 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.154 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.557 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 41.0 m-85 -99.96 -15.29 18.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.606 0.717 . . . . 0.0 110.543 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HG2' ' OH ' ' C' ' 109' ' ' TYR . 1.4 tmtp? -64.46 -33.22 75.38 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.793 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.47 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -101.38 23.77 10.56 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.253 0.549 . . . . 0.0 110.507 179.398 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.465 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 26.5 t -92.75 -26.27 4.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.545 ' O ' ' HD2' ' A' ' 36' ' ' PRO . 10.3 tm-20 -64.35 -69.61 0.27 Allowed 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.903 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -43.64 -38.13 2.91 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -177.394 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.642 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 16.4 m-30 -41.32 -72.35 0.12 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -178.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.642 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 88.5 Cg_endo -79.37 177.45 8.54 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.192 1.928 . . . . 0.0 112.309 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -110.84 91.94 3.86 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.543 ' HA3' ' CE2' ' C' ' 115' ' ' PHE . . . -71.75 159.74 53.87 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.771 -0.728 . . . . 0.0 113.077 -178.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 131.88 -70.01 0.52 Allowed Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.942 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.7 mm . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.321 -0.847 . . . . 0.0 109.904 179.517 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.125 0 N-CA-C 112.027 -0.429 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.478 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 1.0 OUTLIER -57.75 -55.06 48.79 Favored Pre-proline 0 N--CA 1.466 0.334 0 CA-C-N 117.135 0.467 . . . . 0.0 111.132 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 76.6 Cg_exo -40.58 -47.49 4.5 Favored 'Trans proline' 0 C--N 1.364 1.358 0 C-N-CA 123.43 2.753 . . . . 0.0 113.823 -178.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -63.1 -50.05 72.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.79 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.458 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 59.8 t -60.88 -52.24 63.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.558 -0.747 . . . . 0.0 111.155 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -64.45 -30.29 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.036 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.611 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 47.1 t -63.59 -30.55 71.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.638 0.733 . . . . 0.0 109.101 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.567 ' O ' HG13 ' B' ' 52' ' ' VAL . 57.7 tp -73.84 -25.69 60.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.57 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.1 OUTLIER -69.37 -20.29 63.83 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.388 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.611 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.8 mt-30 -77.03 -40.1 47.72 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -69.73 -26.61 64.41 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 114.771 -1.104 . . . . 0.0 109.985 178.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.567 HG13 ' O ' ' B' ' 48' ' ' LEU . 17.5 m -77.54 -34.32 20.37 Favored 'Isoleucine or valine' 0 C--N 1.341 0.223 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.302 179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.526 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 62.9 mm-40 -65.12 -34.33 78.13 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.75 -59.34 5.3 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.865 178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.559 HD11 HG21 ' C' ' 99' ' ' VAL . 45.4 tp -58.98 -39.11 80.76 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.961 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.554 ' HA ' HG12 ' B' ' 59' ' ' VAL . 17.4 pt20 -70.2 -23.36 62.93 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.623 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.576 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -69.36 -29.42 71.81 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.15 -1.024 . . . . 0.0 110.881 177.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.715 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.1 mm100 -74.35 -48.21 29.48 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.365 0.603 . . . . 0.0 110.784 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.598 HG11 HD11 ' A' ' 15' ' ' LEU . 6.9 p -70.75 -26.55 28.34 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 C-N-CA 120.601 -0.439 . . . . 0.0 111.713 -178.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.576 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -71.6 -41.99 68.27 Favored 'General case' 0 N--CA 1.463 0.176 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.361 178.409 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.476 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 6.2 p-80 -76.33 -19.57 58.09 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.595 179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 17.8 mt -72.1 -40.8 67.94 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.627 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -69.23 -34.07 74.27 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -54.7 -63.14 1.25 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.538 -1.21 . . . . 0.0 110.254 178.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.571 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -59.64 -39.87 85.76 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.579 179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.534 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.1 OUTLIER -55.86 -30.04 60.87 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.17 -179.33 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.6 t -59.6 -29.78 68.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.286 0.565 . . . . 0.0 110.79 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -89.07 -15.81 33.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.365 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.571 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 39.2 m-85 -100.66 -15.81 17.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.647 0.737 . . . . 0.0 110.454 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' OH ' ' A' ' 29' ' ' TYR . 1.3 tmtp? -64.5 -32.51 74.18 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.7 -179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -101.61 23.8 10.68 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.731 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.475 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 33.4 t -93.07 -26.54 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.511 ' O ' ' HD2' ' B' ' 76' ' ' PRO . 9.2 tm-20 -64.3 -68.43 0.35 Allowed 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.938 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -44.99 -37.77 4.26 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 -177.14 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.63 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 15.3 m-30 -41.16 -72.52 0.11 Allowed Pre-proline 0 N--CA 1.48 1.025 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -178.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.63 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 83.5 Cg_endo -79.35 179.12 6.68 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 122.296 1.997 . . . . 0.0 112.21 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -112.19 91.43 3.65 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 178.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . 0.521 ' HA3' ' CE2' ' A' ' 35' ' ' PHE . . . -71.36 157.78 53.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.879 -0.676 . . . . 0.0 113.244 -178.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.76 -68.83 0.54 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.802 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.9 mm . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.685 -0.674 . . . . 0.0 109.863 179.334 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.466 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 9.2 mt -62.44 -53.84 54.11 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-O 119.081 -0.485 . . . . 0.0 111.801 179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.466 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 77.6 Cg_exo -41.01 -46.53 5.07 Favored 'Trans proline' 0 C--N 1.358 1.072 0 C-N-CA 123.449 2.766 . . . . 0.0 113.085 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 55.2 t0 -62.71 -51.07 68.62 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.891 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.45 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 62.2 t -60.38 -52.69 58.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.987 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.776 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -64.65 -28.43 69.61 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 40.9 t -66.38 -29.66 69.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.596 0.712 . . . . 0.0 109.289 179.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 62.2 tp -73.66 -24.09 59.94 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.909 179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.776 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -68.61 -23.32 64.44 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.2 mt-30 -75.87 -41.29 52.66 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -69.09 -23.55 64.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.019 178.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 1.1 t -77.59 -40.81 28.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.277 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.512 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 55.4 mm-40 -64.55 -33.09 75.11 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 122.055 0.931 . . . . 0.0 108.56 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -61.72 -58.84 6.44 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.312 -1.313 . . . . 0.0 111.139 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.588 HD11 HG11 ' A' ' 19' ' ' VAL . 42.0 tp -59.52 -40.61 87.69 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.773 -179.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.618 ' HA ' HG23 ' C' ' 99' ' ' VAL . 17.9 pt20 -68.02 -24.15 65.08 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.575 -179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -67.39 -30.95 75.81 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.096 -1.05 . . . . 0.0 110.949 178.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.687 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 9.6 mm100 -72.54 -46.51 54.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.801 0.334 . . . . 0.0 110.269 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.618 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -66.75 -34.69 71.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.216 -0.594 . . . . 0.0 111.53 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -66.85 -41.48 87.29 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.675 -177.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.475 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 5.4 p-80 -77.64 -19.81 54.86 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.101 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.696 HD21 ' HG2' ' A' ' 23' ' ' GLN . 18.1 mt -73.45 -40.3 64.3 Favored 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.657 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -69.82 -34.17 73.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 178.328 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -54.76 -63.18 1.23 Allowed 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.302 -1.317 . . . . 0.0 110.059 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.569 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -59.14 -40.15 84.62 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.853 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.1 OUTLIER -55.63 -31.43 62.3 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 115.989 -0.551 . . . . 0.0 112.091 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 33.7 t -57.58 -29.21 64.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.158 0.504 . . . . 0.0 110.632 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -90.81 -15.65 29.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.592 179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.569 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 41.1 m-85 -100.78 -16.07 17.44 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.499 0.666 . . . . 0.0 110.642 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.441 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 1.0 OUTLIER -67.47 -26.73 66.52 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.972 -179.143 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.1 OUTLIER -104.38 22.43 14.89 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.176 177.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.477 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 37.2 t -92.13 -26.3 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.51 ' O ' ' HD2' ' C' ' 116' ' ' PRO . 9.3 tm-20 -64.28 -68.05 0.38 Allowed 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.905 HD13 ' H ' ' C' ' 114' ' ' LEU . 0.0 OUTLIER -44.82 -39.07 4.99 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 -177.331 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.643 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 15.9 m-30 -40.41 -72.13 0.12 Allowed Pre-proline 0 N--CA 1.481 1.079 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.643 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 88.7 Cg_endo -79.11 179.55 6.36 Favored 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.201 1.934 . . . . 0.0 112.371 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 48.7 t30 -113.03 89.79 3.18 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . 0.544 ' HA3' ' CE2' ' B' ' 75' ' ' PHE . . . -70.24 157.29 53.52 Favored Glycine 0 N--CA 1.448 -0.52 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.33 -178.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 133.79 -69.57 0.53 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 111.642 -0.583 . . . . 0.0 111.642 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 37.1 mm . . . . . 0 C--O 1.245 0.868 0 CA-C-O 118.582 -0.723 . . . . 0.0 109.89 179.386 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.781 ' HA2' HD22 ' B' ' 42' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.879 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.808 HD22 ' HA2' ' C' ' 81' ' ' GLY . 32.6 mt -57.45 -55.38 45.11 Favored Pre-proline 0 N--CA 1.467 0.422 0 CA-C-O 119.254 -0.403 . . . . 0.0 111.566 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.572 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 32.4 Cg_exo -45.58 -46.91 14.13 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.905 2.403 . . . . 0.0 112.323 -179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.839 ' HB3' HH22 ' B' ' 49' ' ' ARG . 3.1 m-20 -58.37 -34.63 70.89 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.425 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.576 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 91.1 t -61.14 -47.93 91.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.217 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.676 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -67.09 -32.43 73.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.935 0.398 . . . . 0.0 110.841 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.702 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 34.5 m -71.4 -23.11 61.81 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.857 0.837 . . . . 0.0 109.506 178.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.406 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 62.0 tp -77.89 -22.53 49.62 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.792 HH22 ' HB3' ' C' ' 84' ' ' ASP . 0.0 OUTLIER -64.14 -44.13 93.13 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.056 178.227 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.702 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.0 OUTLIER -70.39 -47.22 61.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.269 -179.46 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -61.64 -39.12 90.2 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.241 0.543 . . . . 0.0 110.838 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.406 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 2.6 t -73.2 -27.38 24.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.958 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.723 ' HA ' HE21 ' A' ' 16' ' ' GLN . 19.1 tt0 -67.31 -33.64 75.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.66 -60.83 2.51 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.632 178.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' A' ' 15' ' ' LEU . 3.4 mm? -57.32 -37.21 72.13 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.686 -1.143 . . . . 0.0 112.371 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.723 HE21 ' HA ' ' A' ' 13' ' ' GLU . 21.8 pt20 -72.16 -30.41 64.97 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.495 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.43 -30.32 77.31 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 110.164 -1.174 . . . . 0.0 110.164 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.756 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 76.4 mt-30 -70.56 -48.36 55.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.896 -0.652 . . . . 0.0 110.669 178.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 16' ' ' GLN . 0.7 OUTLIER -62.4 -44.03 98.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.93 -179.311 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 10.5 pt20 -59.79 -43.35 94.48 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.68 -0.408 . . . . 0.0 111.316 -178.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.448 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 5.1 p-80 -79.11 -14.55 59.06 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.457 -0.897 . . . . 0.0 111.544 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.756 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 14.2 mt -75.66 -42.43 51.33 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.73 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.1 tm0? -68.77 -38.97 80.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.5 -48.05 72.32 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 114.428 -1.26 . . . . 0.0 109.484 177.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.59 ' O ' ' HG2' ' A' ' 28' ' ' GLN . . . -62.31 -47.15 85.53 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.118 178.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.44 ' CD2' HD22 ' C' ' 102' ' ' LEU . 5.5 m-85 -50.3 -25.77 4.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.811 0.3 . . . . 0.0 111.811 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 47.7 t -49.64 -30.0 8.22 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.634 ' HG3' ' OE1' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -107.84 -11.62 15.34 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.532 ' CE2' ' HA ' ' B' ' 70' ' ' LYS . 55.0 m-85 -94.94 -21.87 18.35 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.771 -0.581 . . . . 0.0 109.696 178.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.557 ' HA ' ' CE2' ' C' ' 109' ' ' TYR . 22.7 pttp -59.64 -21.15 60.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.746 -178.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.438 ' HE2' ' O ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -103.97 33.55 3.4 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.444 178.316 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.691 HG12 HG11 ' C' ' 112' ' ' VAL . 71.1 t -124.91 -24.87 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.963 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.78 ' HG3' HD13 ' A' ' 34' ' ' LEU . 16.9 pt-20 -61.76 -40.77 96.29 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.78 HD13 ' HG3' ' A' ' 33' ' ' GLU . 0.5 OUTLIER -54.82 -74.45 0.04 OUTLIER 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -176.351 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.474 ' CD1' ' N ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -104.31 53.03 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 117.547 2.425 . . . . 0.0 117.547 -174.142 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.455 ' HD2' ' O ' ' A' ' 34' ' ' LEU . 48.0 Cg_endo -64.41 175.28 3.51 Favored 'Trans proline' 0 CA--C 1.533 0.475 0 C-N-CA 121.914 1.743 . . . . 0.0 110.623 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -111.51 80.28 1.3 Allowed 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.183 -0.607 . . . . 0.0 110.911 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -100.66 46.67 1.31 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.442 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -103.6 -88.17 2.04 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.742 -179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 42.1 mm . . . . . 0 C--O 1.244 0.77 0 CA-C-O 118.565 -0.731 . . . . 0.0 110.552 -179.681 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.403 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.872 0 N-CA-C 112.291 -0.324 . . . . 0.0 112.291 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.781 HD22 ' HA2' ' A' ' 1' ' ' GLY . 32.6 mt -58.67 -55.93 40.97 Favored Pre-proline 0 N--CA 1.469 0.49 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.543 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 31.7 Cg_exo -45.23 -45.83 14.48 Favored 'Trans proline' 0 C--N 1.36 1.178 0 C-N-CA 122.996 2.464 . . . . 0.0 112.597 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.821 ' HB3' HH22 ' C' ' 89' ' ' ARG . 2.3 m-20 -59.51 -32.87 70.69 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.517 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.59 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 99.1 t -63.04 -47.44 92.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.95 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.681 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -67.7 -31.84 72.08 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.819 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.721 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 40.5 m -71.47 -23.78 61.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.678 0.751 . . . . 0.0 109.297 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.401 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 64.4 tp -77.57 -22.29 51.19 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 178.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.839 HH22 ' HB3' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -63.94 -44.66 92.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.071 178.045 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.721 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.0 OUTLIER -69.93 -47.69 61.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -61.3 -38.55 87.2 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.455 0.645 . . . . 0.0 110.912 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.401 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 2.6 t -74.03 -27.28 22.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.105 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.736 ' HA ' HE21 ' B' ' 56' ' ' GLN . 22.0 tt0 -67.3 -33.01 74.4 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 178.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.16 -59.83 3.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.215 -1.357 . . . . 0.0 110.835 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.414 HD13 ' HA ' ' B' ' 55' ' ' LEU . 3.4 mm? -58.55 -37.25 75.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.706 -1.134 . . . . 0.0 112.105 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.736 HE21 ' HA ' ' B' ' 53' ' ' GLU . 21.9 pt20 -71.83 -30.09 65.11 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.632 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.401 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -65.44 -31.82 81.51 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.79 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 76.4 mt-30 -69.85 -47.23 63.49 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.928 -0.636 . . . . 0.0 110.727 178.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.451 HG23 ' HA ' ' B' ' 56' ' ' GLN . 0.9 OUTLIER -63.12 -44.62 99.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.693 -179.319 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 56' ' ' GLN . 11.0 pt20 -59.26 -42.44 91.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.6 -178.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.443 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 4.9 p-80 -80.31 -15.07 57.76 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.288 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.79 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.3 mt -74.82 -42.16 58.57 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 177.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 1.9 tm0? -69.12 -38.82 79.1 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 178.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.71 -48.94 71.85 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.202 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.587 ' O ' ' HG2' ' B' ' 68' ' ' GLN . . . -60.95 -47.49 86.17 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.099 178.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.425 ' CD2' HD22 ' A' ' 22' ' ' LEU . 5.3 m-85 -50.38 -26.15 4.65 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . 0.453 ' O ' ' HE3' ' B' ' 70' ' ' LYS . 46.7 t -49.55 -30.11 8.0 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 111.818 0.303 . . . . 0.0 111.818 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.633 ' HG3' ' OE1' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -108.25 -9.34 15.53 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.557 ' HE1' ' HB1' ' B' ' 65' ' ' ALA . 60.6 m-85 -97.27 -21.41 17.27 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.532 ' HA ' ' CE2' ' A' ' 29' ' ' TYR . 22.6 pttp -59.16 -22.05 60.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.668 -178.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -103.5 33.77 3.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.537 0.684 . . . . 0.0 110.584 178.557 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.721 HG11 HG12 ' C' ' 112' ' ' VAL . 72.1 t -125.29 -24.27 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.835 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.806 ' HG3' HD13 ' B' ' 74' ' ' LEU . 17.1 pt-20 -61.8 -40.39 95.05 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.806 HD13 ' HG3' ' B' ' 73' ' ' GLU . 0.5 OUTLIER -55.71 -74.22 0.05 OUTLIER 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -176.089 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.432 ' CD1' ' N ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -104.28 52.21 0.09 OUTLIER Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 117.478 2.399 . . . . 0.0 117.478 -174.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.462 ' HD2' ' O ' ' B' ' 74' ' ' LEU . 44.5 Cg_endo -63.9 176.01 2.69 Favored 'Trans proline' 0 CA--C 1.535 0.573 0 C-N-CA 121.901 1.734 . . . . 0.0 110.527 176.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -112.12 80.36 1.32 Allowed 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.283 -0.567 . . . . 0.0 110.789 179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.32 47.38 1.27 Allowed Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.493 -0.861 . . . . 0.0 112.26 179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -105.19 -88.02 2.03 Favored Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.314 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.4 mm . . . . . 0 C--O 1.247 0.933 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.325 179.73 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.808 ' HA2' HD22 ' A' ' 2' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.803 -0.519 . . . . 0.0 111.803 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.13 -56.02 38.02 Favored Pre-proline 0 N--CA 1.469 0.505 0 CA-C-O 119.357 -0.354 . . . . 0.0 111.671 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -45.75 -46.6 15.01 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.742 2.295 . . . . 0.0 112.626 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . 0.792 ' HB3' HH22 ' A' ' 9' ' ' ARG . 2.6 m-20 -59.28 -31.87 69.51 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.674 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.605 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 93.2 t -63.86 -47.48 90.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.041 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.7 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -67.14 -31.93 72.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.734 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.704 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 22.5 m -71.75 -23.87 61.68 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.811 0.815 . . . . 0.0 109.545 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.41 ' O ' ' HB ' ' C' ' 92' ' ' VAL . 62.9 tp -77.42 -22.32 51.72 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 178.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.821 HH22 ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -64.39 -43.24 95.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.252 178.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.1 pt20 -71.46 -47.35 56.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.196 -179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -61.31 -39.07 89.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.217 0.532 . . . . 0.0 111.005 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' C' ' 88' ' ' LEU . 2.6 t -73.31 -27.81 24.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.068 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.753 ' HA ' HE21 ' C' ' 96' ' ' GLN . 22.9 tt0 -66.86 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.37 -59.98 3.19 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.902 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.6 mm? -58.48 -35.86 72.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.895 -1.048 . . . . 0.0 112.275 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.753 HE21 ' HA ' ' C' ' 93' ' ' GLU . 22.0 pt20 -73.58 -30.26 62.91 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.409 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.45 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -66.23 -29.52 75.07 Favored Glycine 0 C--O 1.238 0.393 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 177.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.772 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 76.3 mt-30 -72.27 -49.55 33.96 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.015 -0.593 . . . . 0.0 111.019 178.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.424 HG21 HG22 ' B' ' 59' ' ' VAL . 1.6 p -66.5 -34.61 71.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 10.4 pt20 -64.89 -43.97 91.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.554 -0.459 . . . . 0.0 111.104 177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.427 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.8 p-80 -77.94 -15.13 59.24 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 119.83 -0.748 . . . . 0.0 111.037 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.772 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.1 mt -73.9 -41.62 61.85 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.2 tm0? -69.95 -37.97 76.0 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -48.14 74.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.379 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.598 ' O ' ' HG2' ' C' ' 108' ' ' GLN . . . -61.25 -47.89 83.96 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.799 178.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.449 ' CD2' HD22 ' B' ' 62' ' ' LEU . 3.0 m-85 -49.6 -26.18 3.39 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . 0.467 ' O ' ' HE3' ' C' ' 110' ' ' LYS . 36.9 t -49.79 -30.52 9.79 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.629 ' HG3' ' OE1' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -106.87 -11.41 15.74 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.557 ' CE2' ' HA ' ' A' ' 30' ' ' LYS . 53.1 m-85 -94.94 -21.93 18.31 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.645 178.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.554 ' HA ' ' CE2' ' B' ' 69' ' ' TYR . 22.8 pttp -59.28 -21.19 59.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.003 -178.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -104.09 33.52 3.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.629 0.728 . . . . 0.0 110.325 178.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.721 HG12 HG11 ' B' ' 72' ' ' VAL . 70.3 t -125.29 -25.92 1.64 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 115.196 -0.911 . . . . 0.0 111.59 -178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.633 ' OE1' ' HG3' ' B' ' 68' ' ' GLN . 16.6 pt-20 -59.7 -42.72 93.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.501 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.4 OUTLIER -55.81 -69.96 0.13 Allowed 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -176.028 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.09 52.09 0.21 Allowed Pre-proline 0 C--N 1.313 -1.01 0 N-CA-C 117.17 2.285 . . . . 0.0 117.17 -175.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.415 ' HD2' ' O ' ' C' ' 114' ' ' LEU . 56.1 Cg_endo -64.01 174.94 3.47 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 122.193 1.928 . . . . 0.0 110.646 176.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -112.15 81.68 1.51 Allowed 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.738 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -101.3 46.66 1.27 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.339 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -103.19 -88.86 2.08 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.479 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 40.5 mm . . . . . 0 C--O 1.244 0.78 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.05 179.685 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.871 0 N-CA-C 112.126 -0.389 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.501 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 6.6 mp -57.9 -57.42 25.83 Favored Pre-proline 0 N--CA 1.467 0.4 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 1.1 Cg_endo -51.07 -36.21 53.86 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 122.993 2.462 . . . . 0.0 112.602 -178.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.98 -34.13 72.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.864 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 69.5 t -76.55 -47.29 29.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.328 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.825 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -70.74 -20.79 62.6 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.74 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.653 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 32.1 t -67.88 -27.63 66.83 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.54 HD11 HG11 ' B' ' 52' ' ' VAL . 65.2 tp -74.34 -22.85 59.04 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.626 178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.825 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 mmt85 -69.5 -22.1 63.63 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 178.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.653 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.5 mt-30 -73.75 -39.31 64.32 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 178.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.471 ' O ' HD23 ' A' ' 15' ' ' LEU . 9.8 mm100 -69.52 -33.17 72.42 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 114.594 -1.185 . . . . 0.0 110.577 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.723 HG22 ' HA ' ' A' ' 9' ' ' ARG . 29.0 m -74.53 -31.61 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.697 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.579 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.2 mt-10 -70.43 -29.73 66.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 176.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.48 -53.03 48.39 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.611 177.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.523 HD11 ' HA ' ' B' ' 56' ' ' GLN . 3.9 mm? -57.71 -37.4 73.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 114.233 -1.349 . . . . 0.0 111.632 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.647 ' HA ' HG12 ' A' ' 19' ' ' VAL . 19.6 pt20 -76.48 -25.03 53.87 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.215 -179.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.873 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -69.7 -37.52 76.63 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.801 -1.19 . . . . 0.0 110.701 178.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.703 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 65.4 mt-30 -72.88 -46.63 51.75 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.026 -0.587 . . . . 0.0 111.321 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.647 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.8 p -69.23 -32.83 55.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.693 -179.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.873 HE21 ' HA2' ' A' ' 17' ' ' GLY . 14.8 pt20 -67.55 -41.74 83.76 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.842 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.412 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.3 p-80 -78.61 -19.44 52.68 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.271 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.733 HD21 ' HG2' ' B' ' 63' ' ' GLN . 14.2 mt -71.95 -43.73 64.75 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 177.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.729 ' HG2' HD21 ' C' ' 102' ' ' LEU . 3.6 tm0? -70.38 -33.34 71.29 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.35 -56.05 26.89 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 114.913 -1.039 . . . . 0.0 109.866 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.731 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.38 -41.38 98.58 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.132 178.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.67 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.96 -26.06 59.02 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.519 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.9 t -53.43 -26.64 20.78 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.27 0.557 . . . . 0.0 110.34 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.1 mm100 -93.02 -53.66 4.05 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.589 178.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.731 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 21.7 m-85 -63.13 -20.15 65.11 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.472 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 0.0 OUTLIER -67.09 -24.27 65.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.781 0.324 . . . . 0.0 110.756 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.84 34.21 3.97 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.748 0.785 . . . . 0.0 109.708 178.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.605 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 10.8 t -98.78 -33.6 4.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.942 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -90.66 88.57 7.16 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 122.707 1.241 . . . . 0.0 111.665 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.645 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -166.44 -32.13 0.03 OUTLIER 'General case' 0 C--N 1.291 -1.97 0 CA-C-N 112.438 -2.165 . . . . 0.0 110.296 178.719 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.645 ' H ' HD23 ' A' ' 34' ' ' LEU . 42.2 m-85 -71.16 -59.7 3.21 Favored Pre-proline 0 CA--C 1.531 0.241 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.598 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 73.8 Cg_endo -78.99 178.74 7.19 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 121.955 1.77 . . . . 0.0 111.583 179.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.524 ' HB2' ' CZ ' ' C' ' 115' ' ' PHE . 6.5 m120 -70.3 -52.07 25.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.765 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.36 -100.18 2.33 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 -178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -89.74 82.18 1.42 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.28 178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.0 tp . . . . . 0 C--O 1.245 0.845 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.424 -179.164 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.417 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.481 1.635 0 N-CA-C 112.273 -0.331 . . . . 0.0 112.273 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.493 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 6.8 mp -59.08 -57.04 30.04 Favored Pre-proline 0 N--CA 1.465 0.294 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 1.2 Cg_endo -50.94 -34.49 46.16 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.987 2.458 . . . . 0.0 112.536 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -70.97 -36.22 72.44 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.697 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.417 HG23 ' O ' ' B' ' 41' ' ' GLY . 79.1 t -75.03 -47.68 35.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.412 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.798 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -70.59 -20.62 62.75 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.641 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 19.3 t -68.42 -26.8 65.72 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.551 HD11 HG11 ' C' ' 92' ' ' VAL . 63.6 tp -74.32 -23.26 59.04 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.522 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.798 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 9.1 mmt85 -69.26 -22.08 63.86 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.3 mt-30 -74.4 -38.16 63.19 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 178.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.475 ' O ' HD23 ' B' ' 55' ' ' LEU . 10.1 mm100 -70.57 -32.94 70.54 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.391 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' B' ' 49' ' ' ARG . 28.0 m -74.73 -31.55 26.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.662 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.588 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 50.7 mt-10 -70.52 -30.03 66.69 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.25 -53.09 49.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.615 177.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' C' ' 96' ' ' GLN . 3.9 mm? -57.46 -37.66 73.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.632 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.643 ' HA ' HG12 ' B' ' 59' ' ' VAL . 19.5 pt20 -76.4 -25.34 54.43 Favored 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 120.385 -0.526 . . . . 0.0 111.368 -178.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.838 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -69.61 -37.43 77.46 Favored Glycine 0 C--O 1.242 0.6 0 C-N-CA 119.929 -1.129 . . . . 0.0 110.663 178.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.7 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 69.3 mt-30 -72.53 -47.18 50.43 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.251 -0.475 . . . . 0.0 111.069 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' B' ' 56' ' ' GLN . 15.0 p -68.74 -32.57 55.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 C-N-CA 120.305 -0.558 . . . . 0.0 112.012 -178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.838 HE21 ' HA2' ' B' ' 57' ' ' GLY . 13.7 pt20 -68.23 -40.91 81.9 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.965 -179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.2 p-80 -79.18 -19.14 51.63 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.141 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.728 HD21 ' HG2' ' C' ' 103' ' ' GLN . 14.6 mt -72.33 -43.19 64.47 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.733 ' HG2' HD21 ' A' ' 22' ' ' LEU . 3.4 tm0? -70.85 -33.75 70.96 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.92 -56.39 22.32 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.913 178.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.756 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.45 -40.77 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.092 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.689 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -57.46 -26.05 60.63 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.485 179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t -53.67 -26.64 23.44 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.166 0.508 . . . . 0.0 110.459 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -92.29 -54.84 3.65 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.459 178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.756 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -62.03 -20.12 63.61 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -67.03 -23.46 65.9 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.849 -179.288 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.82 33.14 4.74 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.621 0.724 . . . . 0.0 109.678 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.632 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 16.2 t -97.1 -34.45 4.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.206 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -89.97 89.57 7.78 Favored 'General case' 0 CA--C 1.511 -0.519 0 CA-C-O 122.549 1.166 . . . . 0.0 111.414 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.627 HD23 ' N ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -167.9 -30.93 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 112.486 -2.143 . . . . 0.0 110.393 178.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.627 ' N ' HD23 ' B' ' 74' ' ' LEU . 42.0 m-85 -72.82 -58.78 2.55 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 177.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.577 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 75.7 Cg_endo -79.47 178.45 7.37 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.05 1.833 . . . . 0.0 111.814 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . 0.488 ' HB2' ' CZ ' ' A' ' 35' ' ' PHE . 7.0 m120 -70.59 -47.55 59.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.271 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 80.23 -102.26 2.04 Favored Glycine 0 N--CA 1.451 -0.322 0 N-CA-C 110.967 -0.853 . . . . 0.0 110.967 -178.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -89.39 85.03 1.41 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.25 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.415 ' HB ' ' HB3' ' B' ' 77' ' ' ASN . 8.7 tp . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.513 -0.756 . . . . 0.0 110.731 -178.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.408 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.735 0 N-CA-C 112.166 -0.374 . . . . 0.0 112.166 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.509 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 9.5 mt -59.99 -55.6 43.95 Favored Pre-proline 0 N--CA 1.468 0.436 0 CA-C-N 116.708 0.254 . . . . 0.0 111.67 179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 1.3 Cg_endo -51.64 -33.91 50.93 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 123.055 2.503 . . . . 0.0 112.757 -178.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -72.14 -34.61 68.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.519 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.408 HG23 ' O ' ' C' ' 81' ' ' GLY . 69.1 t -76.55 -47.46 29.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.225 178.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.828 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -70.5 -20.82 62.81 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.649 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 25.0 t -67.94 -27.35 66.54 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.571 HD11 HG11 ' A' ' 12' ' ' VAL . 65.8 tp -74.26 -22.8 59.16 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.761 179.259 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.828 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 9.0 mmt85 -69.59 -22.48 63.51 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 178.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.649 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.6 mt-30 -74.26 -37.21 63.82 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.469 ' O ' HD23 ' C' ' 95' ' ' LEU . 10.2 mm100 -71.63 -32.75 68.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.29 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.746 HG22 ' HA ' ' C' ' 89' ' ' ARG . 27.5 m -74.63 -31.83 27.97 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.609 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.552 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 49.5 mt-10 -69.72 -30.72 68.41 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 108.334 -0.988 . . . . 0.0 108.334 177.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.03 -52.98 52.89 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.777 -1.102 . . . . 0.0 109.706 177.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.517 HD11 ' HA ' ' A' ' 16' ' ' GLN . 3.8 mm? -57.6 -37.69 73.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.278 -1.328 . . . . 0.0 111.696 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.664 ' HA ' HG12 ' C' ' 99' ' ' VAL . 19.5 pt20 -76.23 -25.15 54.76 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.307 -0.557 . . . . 0.0 111.318 -179.061 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.832 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -69.69 -37.2 76.52 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 119.9 -1.143 . . . . 0.0 110.729 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.709 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 68.1 mt-30 -73.34 -46.26 50.28 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.419 . . . . 0.0 111.22 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.664 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.7 p -69.45 -32.47 53.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.667 -178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.832 HE21 ' HA2' ' C' ' 97' ' ' GLY . 15.4 pt20 -67.84 -42.17 81.83 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.866 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.1 p-80 -78.43 -18.88 54.31 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 119.358 -0.937 . . . . 0.0 110.454 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.729 HD21 ' HG2' ' A' ' 23' ' ' GLN . 14.3 mt -72.4 -43.59 63.69 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 177.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.728 ' HG2' HD21 ' B' ' 62' ' ' LEU . 3.0 tm0? -70.12 -34.19 72.77 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 178.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.63 -55.86 28.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.24 178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.742 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.45 -40.8 98.09 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.829 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.695 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -57.57 -24.43 56.21 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.728 179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 31.5 t -55.46 -26.46 42.4 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.889 0.376 . . . . 0.0 110.391 179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -92.78 -52.94 4.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.272 178.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.742 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 22.0 m-85 -63.18 -20.51 65.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 0.1 OUTLIER -66.49 -25.91 66.93 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.837 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.531 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -107.66 35.08 3.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.832 0.825 . . . . 0.0 109.949 178.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.566 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 12.6 t -99.42 -35.83 5.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.166 179.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.563 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 27.1 tt0 -88.92 90.46 8.42 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-O 122.681 1.229 . . . . 0.0 111.141 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.683 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -167.46 -37.41 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 112.581 -2.1 . . . . 0.0 109.421 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.683 ' H ' HD12 ' C' ' 114' ' ' LEU . 42.2 m-85 -67.71 -59.58 6.59 Favored Pre-proline 0 N--CA 1.467 0.399 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.789 177.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.583 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 73.7 Cg_endo -79.33 -179.69 5.63 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.986 1.791 . . . . 0.0 111.565 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . 0.505 ' HB2' ' CZ ' ' B' ' 75' ' ' PHE . 6.0 m120 -72.45 -48.6 39.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.647 0.261 . . . . 0.0 111.134 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.11 -100.46 2.0 Favored Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -89.1 82.7 1.46 Allowed Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 111.303 -0.719 . . . . 0.0 111.303 178.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . 0.417 ' HB ' ' HB3' ' C' ' 117' ' ' ASN . 8.8 tp . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.342 -0.837 . . . . 0.0 110.454 -179.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.459 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.794 0 N-CA-C 112.306 -0.318 . . . . 0.0 112.306 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.531 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 60.5 mt -55.7 -53.2 65.31 Favored Pre-proline 0 CA--C 1.532 0.279 0 CA-C-O 119.291 -0.385 . . . . 0.0 111.947 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.531 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 77.0 Cg_exo -46.34 -46.14 17.48 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 122.803 2.335 . . . . 0.0 112.918 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -61.15 -33.43 73.41 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.221 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 1' ' ' GLY . 60.1 t -63.27 -55.72 21.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.76 -41.82 95.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.89 0.376 . . . . 0.0 111.416 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.496 ' O ' ' HG2' ' A' ' 10' ' ' GLN . 23.4 m -63.7 -31.03 72.07 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-O 122.095 0.95 . . . . 0.0 110.353 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.958 HD11 HG21 ' B' ' 52' ' ' VAL . 37.0 tp -75.18 -54.54 6.95 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.81 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.878 ' HB3' HD22 ' C' ' 88' ' ' LEU . 0.0 OUTLIER -58.26 -28.58 65.05 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 123.44 0.463 . . . . 0.0 112.067 -179.024 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 2.7 pt20 -70.63 -42.4 70.94 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 177.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -65.63 -10.3 34.64 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.948 177.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.92 HG21 HD11 ' C' ' 88' ' ' LEU . 15.7 t -78.57 -38.57 22.33 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-O 120.458 0.17 . . . . 0.0 110.769 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 21.9 pt-20 -73.26 -19.17 61.12 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.9 -49.63 23.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.349 -1.296 . . . . 0.0 109.513 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' B' ' 55' ' ' LEU . 10.4 tp -61.71 -33.58 74.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.351 179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.593 ' HA ' HD21 ' C' ' 95' ' ' LEU . 1.9 tp-100 -68.53 -42.32 78.65 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.581 177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.65 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -60.77 -30.04 71.71 Favored Glycine 0 C--O 1.236 0.235 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.513 ' HA ' ' ND1' ' A' ' 21' ' ' HIS . 73.5 mt-30 -73.31 -47.4 42.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.263 0.554 . . . . 0.0 110.834 179.122 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 3.1 p -69.64 -26.41 30.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.134 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.337 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 1.7 pt20 -73.6 -39.58 64.49 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.513 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 9.7 p-80 -80.44 -12.29 59.58 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.02 -0.672 . . . . 0.0 109.783 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.683 HD21 ' HG2' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -76.01 -39.21 56.24 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 176.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.929 ' HG2' HD11 ' C' ' 102' ' ' LEU . 69.8 mt-30 -70.74 -31.13 67.85 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 177.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.24 -44.17 97.17 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.642 177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.624 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.18 -49.67 76.25 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.585 -1.189 . . . . 0.0 108.732 178.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.494 ' CE2' ' HG ' ' C' ' 102' ' ' LEU . 6.5 m-85 -54.96 -25.71 31.54 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.984 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -51.63 -31.8 26.66 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 110.748 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.422 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 76.0 mt-30 -88.55 -54.58 4.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.371 0.605 . . . . 0.0 110.502 178.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.679 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 14.4 m-85 -63.74 -19.46 64.97 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -177.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 21.0 ptmt -68.91 -30.29 68.73 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.611 0.243 . . . . 0.0 110.883 -179.323 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -102.15 28.16 6.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.899 0.857 . . . . 0.0 109.813 178.394 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.679 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 24.4 t -94.03 -44.34 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.577 179.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 5.6 tt0 -111.6 109.76 19.82 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-O 122.276 1.036 . . . . 0.0 110.065 177.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.856 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -172.29 -33.86 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 113.013 -1.903 . . . . 0.0 109.434 -179.049 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.856 ' H ' HD23 ' A' ' 34' ' ' LEU . 18.1 m-85 -70.5 -53.82 9.41 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.032 177.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.719 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 84.1 Cg_endo -82.51 -177.06 3.23 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.391 2.061 . . . . 0.0 112.159 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.8 p30 -135.07 13.53 3.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.682 0.277 . . . . 0.0 111.393 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.47 -99.94 1.91 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.526 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 123.35 8.49 6.44 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.159 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 38.5 mm . . . . . 0 C--O 1.243 0.722 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.29 179.456 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.466 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.95 0 N-CA-C 112.409 -0.276 . . . . 0.0 112.409 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.524 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 62.6 mt -56.64 -52.16 75.7 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 71.9 Cg_exo -47.32 -46.23 20.36 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 122.782 2.322 . . . . 0.0 112.679 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -60.25 -35.13 74.79 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.913 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.466 HG23 ' O ' ' B' ' 41' ' ' GLY . 58.2 t -61.88 -55.09 26.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.194 -179.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.86 -41.04 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.765 0.317 . . . . 0.0 111.244 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' B' ' 50' ' ' GLN . 35.2 m -63.72 -31.38 72.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.259 1.028 . . . . 0.0 110.241 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.969 HD11 HG21 ' C' ' 92' ' ' VAL . 34.5 tp -75.07 -54.91 6.34 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.827 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.916 ' HB3' HD22 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -57.61 -28.96 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.465 0.478 . . . . 0.0 111.969 -178.818 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' B' ' 53' ' ' GLU . 2.6 pt20 -70.43 -42.87 71.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 177.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -65.59 -10.58 36.73 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.629 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.958 HG21 HD11 ' A' ' 8' ' ' LEU . 16.2 t -78.18 -37.95 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.961 -179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' B' ' 50' ' ' GLN . 22.9 pt-20 -74.08 -18.69 60.78 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -74.37 -48.52 27.46 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.184 177.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.832 HD21 ' HB3' ' C' ' 95' ' ' LEU . 10.8 tp -62.66 -32.86 73.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.377 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -69.42 -42.65 74.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.577 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.632 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.99 -30.26 69.66 Favored Glycine 0 CA--C 1.52 0.375 0 N-CA-C 111.124 -0.791 . . . . 0.0 111.124 178.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.511 ' HA ' ' ND1' ' B' ' 61' ' ' HIS . 73.3 mt-30 -72.62 -48.86 36.1 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.341 0.591 . . . . 0.0 111.046 179.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 2.4 p -69.14 -26.2 31.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.254 -178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.632 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 1.7 pt20 -73.59 -39.48 64.59 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.511 ' ND1' ' HA ' ' B' ' 58' ' ' GLN . 9.5 p-80 -80.63 -11.4 59.65 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 119.597 -0.841 . . . . 0.0 109.813 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.594 HD21 ' HG2' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -76.46 -38.83 54.79 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 176.132 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.683 ' HG2' HD21 ' A' ' 22' ' ' LEU . 70.8 mt-30 -70.76 -31.27 68.02 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 177.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -44.56 96.35 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 114.588 -1.187 . . . . 0.0 108.542 177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.82 -49.65 76.63 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.879 178.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.617 ' HE2' HD13 ' A' ' 22' ' ' LEU . 6.7 m-85 -55.56 -25.37 37.54 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.898 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 18.2 t -52.3 -31.13 31.52 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-N 118.045 0.384 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.434 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 76.8 mt-30 -88.56 -54.48 4.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.33 0.585 . . . . 0.0 110.621 178.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.685 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 14.9 m-85 -63.66 -20.05 65.39 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.563 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 21.1 ptmt -68.55 -30.5 69.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.645 0.26 . . . . 0.0 110.89 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.642 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.38 26.48 7.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.644 0.735 . . . . 0.0 110.068 178.442 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.685 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 25.0 t -92.47 -44.14 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 114.749 -1.114 . . . . 0.0 109.953 178.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.636 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 10.0 tt0 -112.28 109.93 19.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.32 1.057 . . . . 0.0 109.787 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.853 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -172.31 -33.8 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.953 -1.93 . . . . 0.0 109.161 -178.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.853 ' H ' HD23 ' B' ' 74' ' ' LEU . 18.4 m-85 -70.87 -53.85 8.4 Favored Pre-proline 0 CA--C 1.534 0.342 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.244 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 71.9 Cg_endo -82.03 -176.14 2.86 Favored 'Trans proline' 0 C--N 1.357 0.98 0 C-N-CA 122.3 2.0 . . . . 0.0 112.143 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 18.3 p30 -135.46 12.22 3.49 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.176 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.54 -99.43 1.84 Allowed Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.386 -0.686 . . . . 0.0 111.386 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.31 6.35 6.87 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 120.199 -1.0 . . . . 0.0 113.046 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 mm . . . . . 0 C--O 1.243 0.729 0 CA-C-O 118.4 -0.81 . . . . 0.0 110.13 179.712 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.444 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.898 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.516 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 67.8 mt -57.07 -53.92 60.06 Favored Pre-proline 0 N--CA 1.465 0.296 0 CA-C-O 119.174 -0.441 . . . . 0.0 111.733 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.516 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 71.0 Cg_exo -45.48 -45.42 15.81 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.617 2.212 . . . . 0.0 112.674 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -61.67 -33.19 73.54 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.476 -0.783 . . . . 0.0 111.299 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.444 HG23 ' O ' ' C' ' 81' ' ' GLY . 66.4 t -63.54 -56.03 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.426 0.453 . . . . 0.0 110.863 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.511 ' O ' ' HG2' ' C' ' 90' ' ' GLN . . . -63.85 -43.31 96.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 110.97 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 40.6 m -62.47 -30.58 71.36 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.937 0.875 . . . . 0.0 110.649 179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.92 HD11 HG21 ' A' ' 12' ' ' VAL . 32.8 tp -76.85 -53.53 7.78 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.778 -179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.886 ' HB3' HD22 ' B' ' 48' ' ' LEU . 0.0 OUTLIER -57.83 -29.52 65.01 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.528 0.518 . . . . 0.0 111.708 -179.033 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' C' ' 93' ' ' GLU . 2.9 pt20 -69.72 -43.28 72.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 176.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.437 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 71.9 mt-30 -64.42 -11.82 37.02 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.915 177.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.969 HG21 HD11 ' B' ' 48' ' ' LEU . 17.2 t -77.36 -38.85 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 O-C-N 122.346 -0.221 . . . . 0.0 111.141 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' C' ' 90' ' ' GLN . 21.8 pt-20 -73.51 -17.21 61.24 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 178.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -74.86 -49.38 20.7 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.35 177.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.832 ' HB3' HD21 ' B' ' 55' ' ' LEU . 3.3 mt -59.76 -37.1 78.1 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.617 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -66.07 -40.81 91.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.69 -1.141 . . . . 0.0 109.622 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.618 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -61.38 -30.28 73.81 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.524 ' HA ' ' ND1' ' C' ' 101' ' ' HIS . 73.4 mt-30 -73.59 -47.86 37.14 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.751 -0.264 . . . . 0.0 110.578 179.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.491 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -65.9 -32.31 57.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.389 179.334 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 1.7 pt20 -68.36 -39.73 81.71 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -178.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.524 ' ND1' ' HA ' ' C' ' 98' ' ' GLN . 13.0 p-80 -81.43 -10.54 59.49 Favored 'General case' 0 N--CA 1.448 -0.529 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.795 178.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.929 HD11 ' HG2' ' A' ' 23' ' ' GLN . 0.8 OUTLIER -81.4 -33.5 32.19 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 177.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.594 ' HG2' HD21 ' B' ' 62' ' ' LEU . 71.5 mt-30 -74.45 -29.52 61.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 175.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -62.99 -44.91 94.72 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 114.103 -1.408 . . . . 0.0 108.478 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -60.92 -49.99 75.22 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.688 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.539 ' CE2' HD13 ' B' ' 62' ' ' LEU . 6.5 m-85 -55.04 -25.73 32.56 Favored 'General case' 0 C--O 1.212 -0.907 0 CA-C-N 115.136 -0.938 . . . . 0.0 112.092 179.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 22.6 t -51.69 -30.47 22.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 118.105 0.411 . . . . 0.0 110.594 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.439 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 77.0 mt-30 -89.66 -54.6 3.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.556 0.693 . . . . 0.0 110.678 178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.677 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 14.4 m-85 -63.46 -20.2 65.38 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.985 -1.007 . . . . 0.0 113.56 -177.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.569 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 21.3 ptmt -68.37 -30.03 68.87 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.625 0.25 . . . . 0.0 111.154 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.636 ' HE3' ' OE2' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -101.99 27.04 6.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.693 0.759 . . . . 0.0 109.924 178.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.677 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 24.9 t -92.94 -44.22 13.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.903 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.642 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 6.2 tt0 -112.31 109.54 19.24 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-O 122.164 0.983 . . . . 0.0 109.838 177.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.874 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.0 OUTLIER -171.87 -34.61 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.653 0 CA-C-N 113.033 -1.894 . . . . 0.0 108.977 -178.66 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.874 ' H ' HD23 ' C' ' 114' ' ' LEU . 17.0 m-85 -70.39 -54.17 9.27 Favored Pre-proline 0 N--CA 1.453 -0.317 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.27 177.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.69 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 81.6 Cg_endo -82.33 -178.93 4.3 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.223 1.949 . . . . 0.0 112.147 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -132.13 11.93 4.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.777 0.322 . . . . 0.0 111.149 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 102.87 -100.62 1.98 Allowed Glycine 0 N--CA 1.448 -0.523 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 126.44 6.16 5.78 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.135 -1.031 . . . . 0.0 112.957 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 40.1 mm . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.41 -0.805 . . . . 0.0 110.4 179.829 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.927 0 N-CA-C 112.078 -0.409 . . . . 0.0 112.078 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.535 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 3.4 mm? -61.46 -54.6 50.94 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.061 179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.535 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 74.9 Cg_exo -44.35 -42.82 13.71 Favored 'Trans proline' 0 C--N 1.361 1.185 0 C-N-CA 122.965 2.443 . . . . 0.0 113.125 -178.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -63.12 -34.3 77.31 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.133 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.5 t -59.52 -54.75 30.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.437 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.542 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -65.78 -37.38 86.16 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.894 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.748 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.1 m -65.96 -22.9 66.5 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.585 0.707 . . . . 0.0 109.899 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.751 ' O ' HG23 ' A' ' 12' ' ' VAL . 52.7 tp -75.91 -30.57 58.8 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.231 179.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.542 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mmm-85 -62.88 -39.62 95.02 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.748 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -68.48 -37.21 79.92 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.59 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 7' ' ' SER . 82.7 mt-30 -64.24 -30.0 71.07 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.213 0.53 . . . . 0.0 109.868 178.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.751 HG23 ' O ' ' A' ' 8' ' ' LEU . 83.4 t -72.68 -40.27 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.501 ' HA ' HE21 ' A' ' 16' ' ' GLN . 13.8 tp10 -63.25 -33.99 76.69 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 122.159 0.981 . . . . 0.0 108.779 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.01 -61.29 2.36 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.087 -1.415 . . . . 0.0 111.268 178.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.516 HD21 HG11 ' B' ' 59' ' ' VAL . 2.6 tm? -59.51 -38.87 82.08 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.416 -1.266 . . . . 0.0 111.662 -178.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.534 ' HA ' HG12 ' A' ' 19' ' ' VAL . 22.5 pt20 -70.77 -23.32 62.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.436 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.651 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.36 -27.55 73.54 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.035 -1.078 . . . . 0.0 110.44 177.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 80.1 mm-40 -75.04 -48.12 25.58 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.086 0.47 . . . . 0.0 110.71 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 16' ' ' GLN . 2.4 p -67.97 -33.39 60.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.817 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.651 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 11.2 pt20 -66.32 -43.92 84.85 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.877 178.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.502 ' N ' ' HG3' ' A' ' 20' ' ' GLN . 7.8 p-80 -76.34 -16.08 59.83 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 119.532 -0.867 . . . . 0.0 110.747 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.9 mt -73.3 -36.93 66.36 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.535 ' HG2' HD21 ' C' ' 102' ' ' LEU . 2.8 tm0? -70.99 -33.98 70.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 177.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -58.41 -51.91 67.84 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.704 177.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.711 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.58 -38.6 90.76 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.507 178.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.429 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 0.3 OUTLIER -55.7 -30.03 60.41 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.369 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 21.6 t -49.22 -27.3 3.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 120.993 0.425 . . . . 0.0 111.13 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -96.04 -45.61 6.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.681 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.711 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 22.4 m-85 -68.42 -21.51 64.66 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -178.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 45.9 mtpt -71.21 -28.68 64.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.721 0.295 . . . . 0.0 111.159 -179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.447 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -100.17 30.31 3.87 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.665 0.745 . . . . 0.0 109.677 178.592 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.565 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 13.0 t -95.66 -42.56 12.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.952 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.54 ' HB2' HG22 ' C' ' 112' ' ' VAL . 18.9 tt0 -103.44 101.87 11.77 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 122.086 0.946 . . . . 0.0 111.034 178.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.805 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -175.7 -33.41 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.683 0 CA-C-N 112.905 -1.952 . . . . 0.0 110.291 179.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.805 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -117.22 -9.91 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.204 0 N-CA-C 115.532 1.678 . . . . 0.0 115.532 178.783 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.505 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 66.8 Cg_endo -84.86 167.51 11.18 Favored 'Trans proline' 0 C--N 1.366 1.478 0 CA-C-N 122.305 1.859 . . . . 0.0 113.382 -178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -132.84 175.13 9.61 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.162 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -89.71 125.36 7.81 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.107 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -96.19 17.69 58.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.279 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 35.8 mt . . . . . 0 C--O 1.243 0.758 0 CA-C-O 118.607 -0.711 . . . . 0.0 109.967 179.729 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.524 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 3.4 mm? -61.22 -54.3 54.72 Favored Pre-proline 0 N--CA 1.469 0.506 0 CA-C-O 119.302 -0.38 . . . . 0.0 111.226 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 77.9 Cg_exo -44.34 -42.27 13.63 Favored 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 123.044 2.496 . . . . 0.0 113.079 -178.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -63.66 -34.82 78.69 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.308 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 87.1 t -58.83 -55.04 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.475 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.535 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -65.72 -37.55 86.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.195 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.734 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 51.1 m -66.25 -22.29 66.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.641 0.734 . . . . 0.0 109.76 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.738 ' O ' HG23 ' B' ' 52' ' ' VAL . 50.6 tp -75.93 -31.12 58.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.321 178.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.536 ' HE ' HD13 ' A' ' 8' ' ' LEU . 16.7 mmm-85 -62.75 -39.74 95.08 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.734 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -68.0 -37.72 81.79 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.717 178.657 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' B' ' 47' ' ' SER . 82.3 mt-30 -63.99 -30.21 71.3 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.459 0.647 . . . . 0.0 109.889 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.738 HG23 ' O ' ' B' ' 48' ' ' LEU . 77.6 t -71.72 -41.48 70.71 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.046 179.211 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.521 ' HA ' HE21 ' B' ' 56' ' ' GLN . 15.1 tp10 -62.04 -33.57 74.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 122.218 1.009 . . . . 0.0 108.93 179.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -64.71 -60.67 2.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.062 -1.426 . . . . 0.0 111.465 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.406 HD21 HG21 ' C' ' 99' ' ' VAL . 2.6 tm? -59.99 -38.87 83.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.568 -1.197 . . . . 0.0 111.571 -178.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' B' ' 59' ' ' VAL . 22.3 pt20 -70.27 -24.41 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.384 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.64 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -66.99 -26.7 73.27 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 119.924 -1.131 . . . . 0.0 110.441 177.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 80.9 mm-40 -75.86 -48.6 20.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 121.317 0.58 . . . . 0.0 110.72 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.543 HG12 ' HA ' ' B' ' 56' ' ' GLN . 2.4 p -67.93 -31.69 53.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.687 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.64 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.7 pt20 -67.74 -43.67 79.38 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.785 178.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.526 ' N ' ' HG3' ' B' ' 60' ' ' GLN . 7.7 p-80 -76.47 -14.92 60.01 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 119.51 -0.876 . . . . 0.0 110.657 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.6 mt -74.57 -37.9 62.83 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.134 -1.062 . . . . 0.0 108.134 176.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.554 ' HG2' HD21 ' A' ' 22' ' ' LEU . 2.1 tm0? -70.29 -33.8 71.99 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 107.505 -1.295 . . . . 0.0 107.505 177.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -58.46 -51.0 71.71 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.787 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.704 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.89 -38.84 92.51 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.572 178.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.421 ' O ' ' HG3' ' B' ' 70' ' ' LYS . 0.3 OUTLIER -56.07 -29.55 60.69 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.269 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 22.7 t -50.07 -26.37 4.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.082 0.468 . . . . 0.0 110.841 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -96.34 -46.29 6.46 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.621 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.704 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.6 m-85 -68.54 -21.14 64.57 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -178.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 48.0 mtpt -71.63 -27.3 63.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.744 0.307 . . . . 0.0 110.982 -179.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.485 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -101.66 30.9 4.06 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.724 0.773 . . . . 0.0 109.649 178.209 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.582 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 12.6 t -96.24 -42.94 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.528 0 CA-C-N 114.757 -1.111 . . . . 0.0 110.794 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.498 ' HB2' ' CG2' ' A' ' 32' ' ' VAL . 20.3 tt0 -103.32 101.74 11.68 Favored 'General case' 0 CA--C 1.504 -0.789 0 CA-C-O 122.13 0.967 . . . . 0.0 111.252 178.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.835 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -176.32 -33.13 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 112.863 -1.971 . . . . 0.0 110.257 179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.835 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -117.32 -9.43 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.989 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 178.622 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 63.6 Cg_endo -85.75 168.0 9.73 Favored 'Trans proline' 0 C--N 1.366 1.494 0 CA-C-N 122.572 1.954 . . . . 0.0 113.191 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -132.86 175.3 9.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.433 179.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.51 125.41 7.81 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.213 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.69 15.93 62.19 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.189 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 25.5 mt . . . . . 0 C--O 1.244 0.786 0 CA-C-O 118.462 -0.78 . . . . 0.0 109.735 179.41 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.533 0 N-CA-C 112.066 -0.414 . . . . 0.0 112.066 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.4 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 1.3 mt -65.95 -52.83 38.21 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.02 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.4 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 62.6 Cg_exo -44.03 -41.09 12.45 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.66 2.24 . . . . 0.0 112.58 179.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -64.21 -35.09 79.67 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.144 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 98.6 t -58.12 -55.41 22.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.693 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.474 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -65.73 -37.1 85.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.94 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.759 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 49.1 m -66.82 -23.18 66.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.476 0.655 . . . . 0.0 109.653 178.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.529 ' O ' HG12 ' C' ' 92' ' ' VAL . 49.3 tp -73.96 -32.06 63.3 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.851 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.629 ' HA ' HG13 ' C' ' 92' ' ' VAL . 13.3 mmm-85 -63.27 -37.97 89.33 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.759 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -68.56 -36.74 79.18 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' C' ' 87' ' ' SER . 81.8 mt-30 -64.13 -33.14 75.11 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.128 177.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.629 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -75.11 -31.89 25.61 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.942 179.576 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.525 ' HA ' HE21 ' C' ' 96' ' ' GLN . 15.8 tp10 -64.64 -36.33 83.91 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.35 -59.75 4.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.522 -1.217 . . . . 0.0 111.322 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.528 HD21 HG11 ' A' ' 19' ' ' VAL . 2.5 tm? -58.93 -40.21 83.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.551 -178.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.675 ' HA ' HG23 ' C' ' 99' ' ' VAL . 20.8 pt20 -69.35 -24.3 63.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.483 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.733 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -66.13 -28.18 73.49 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 110.356 -1.097 . . . . 0.0 110.356 177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.718 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 78.8 mm-40 -74.43 -46.27 41.06 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.373 -0.414 . . . . 0.0 110.414 178.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.675 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.2 OUTLIER -64.01 -41.69 93.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 C-N-CA 120.421 -0.511 . . . . 0.0 111.169 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.733 HE21 ' HA2' ' C' ' 97' ' ' GLY . 14.5 pt20 -61.87 -43.15 99.43 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.031 -177.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.553 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.2 p-80 -78.55 -14.85 59.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.774 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.718 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.3 mt -74.21 -37.91 63.74 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' B' ' 62' ' ' LEU . 2.2 tm0? -71.08 -34.19 70.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -58.13 -51.51 69.42 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.408 -1.269 . . . . 0.0 109.396 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.721 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.09 -38.14 90.01 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.804 178.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.539 ' HB3' ' HG3' ' C' ' 110' ' ' LYS . 1.0 OUTLIER -56.32 -29.67 61.59 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 123.451 0.469 . . . . 0.0 111.016 178.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 29.6 t -48.37 -26.94 2.29 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.107 0.48 . . . . 0.0 111.024 -179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -96.98 -46.5 6.18 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.909 177.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.721 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 21.5 m-85 -68.48 -20.57 64.61 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -178.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.539 ' HG3' ' HB3' ' C' ' 106' ' ' PHE . 44.3 mtpt -72.11 -28.1 63.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.606 ' HA ' HD21 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -101.33 31.51 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.832 0.825 . . . . 0.0 109.84 178.157 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.564 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -96.49 -42.82 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.956 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.562 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 20.6 tt0 -103.04 100.85 10.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.287 1.042 . . . . 0.0 111.306 178.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.638 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -173.21 -37.5 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 112.794 -2.003 . . . . 0.0 109.847 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.638 ' H ' HD12 ' C' ' 114' ' ' LEU . 0.2 OUTLIER -114.99 -9.96 0.1 OUTLIER Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 115.833 1.79 . . . . 0.0 115.833 -179.659 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 67.7 Cg_endo -84.47 168.02 11.61 Favored 'Trans proline' 0 C--N 1.359 1.121 0 CA-C-N 122.512 1.933 . . . . 0.0 113.269 -178.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -133.4 175.36 9.48 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.399 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -89.77 123.22 6.84 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.539 -0.838 . . . . 0.0 112.348 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -92.77 11.3 72.41 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.673 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 26.3 mt . . . . . 0 C--O 1.243 0.718 0 CA-C-O 118.588 -0.72 . . . . 0.0 110.01 179.493 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.986 0 N-CA-C 112.464 -0.255 . . . . 0.0 112.464 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.43 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 3.8 mm? -58.96 -55.08 50.1 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-O 119.253 -0.404 . . . . 0.0 111.788 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.43 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 71.6 Cg_exo -44.17 -44.47 12.61 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 122.878 2.385 . . . . 0.0 112.89 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -61.82 -37.55 84.85 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.249 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.549 HG11 HG22 ' C' ' 85' ' ' VAL . 61.4 t -64.04 -47.86 88.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.464 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.462 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -68.41 -29.29 67.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.752 179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.59 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 49.2 m -70.02 -22.51 63.09 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.949 0.88 . . . . 0.0 109.391 178.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.2 tp -76.8 -21.72 54.7 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.513 178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.655 ' O ' HG12 ' A' ' 12' ' ' VAL . 7.9 mmm180 -67.56 -33.9 75.96 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -71.7 -47.12 56.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.675 179.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -64.53 -27.75 69.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.281 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.655 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.0 OUTLIER -77.64 -36.92 23.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.766 -178.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.499 ' HA ' ' HG2' ' A' ' 16' ' ' GLN . 48.7 mt-10 -69.99 -28.6 65.66 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 176.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.29 -50.93 63.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.578 -1.192 . . . . 0.0 110.341 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.434 ' O ' HG23 ' A' ' 19' ' ' VAL . 28.0 tp -60.79 -39.13 87.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.124 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.499 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 16.1 pt20 -71.42 -23.45 61.86 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 119.909 -0.716 . . . . 0.0 110.325 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.6 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -68.34 -28.36 73.31 Favored Glycine 0 C--O 1.24 0.521 0 C-N-CA 120.061 -1.066 . . . . 0.0 110.441 177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.678 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 10.3 mm-40 -73.65 -42.77 60.96 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.98 0.419 . . . . 0.0 110.005 178.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.554 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 3.4 t -65.94 -42.58 92.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.159 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.6 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 8.6 pt20 -62.33 -41.44 98.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.539 -179.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' ND1' ' HA ' ' A' ' 18' ' ' GLN . 6.9 p-80 -79.26 -17.38 54.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.157 -1.017 . . . . 0.0 110.806 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.678 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.3 mt -71.95 -47.57 51.38 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.718 ' HA ' ' HB2' ' A' ' 26' ' ' PHE . 13.2 pt20 -71.36 -22.7 61.86 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -62.21 -51.3 68.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 177.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.634 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -63.01 -41.64 99.63 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.548 177.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.718 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -52.03 -29.13 19.73 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.616 -1.175 . . . . 0.0 111.692 178.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 43.4 t -47.67 -33.47 6.89 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 121.15 0.5 . . . . 0.0 111.008 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.87 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 69.6 mt-30 -86.73 -51.51 6.07 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.457 0.646 . . . . 0.0 110.884 178.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.666 ' HA ' ' CG2' ' A' ' 32' ' ' VAL . 15.3 m-85 -63.94 -21.31 66.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.29 -0.868 . . . . 0.0 113.167 -177.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.474 ' HD2' ' CE2' ' C' ' 109' ' ' TYR . 10.4 mmmm -64.63 -32.2 73.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.963 0.411 . . . . 0.0 110.51 179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.87 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -108.52 35.91 3.02 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.095 0.474 . . . . 0.0 110.763 179.394 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.666 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 5.9 t -95.66 -43.59 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.575 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.444 ' HB2' HG22 ' C' ' 112' ' ' VAL . 33.7 tt0 -104.52 102.35 11.98 Favored 'General case' 0 CA--C 1.503 -0.837 0 CA-C-O 122.084 0.945 . . . . 0.0 110.551 178.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.913 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -175.12 -39.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 113.041 -1.89 . . . . 0.0 111.288 -179.254 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.913 ' H ' HD23 ' A' ' 34' ' ' LEU . 4.7 p90 -98.08 -25.73 0.24 Allowed Pre-proline 0 CA--C 1.547 0.851 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.65 ' HD2' ' H ' ' A' ' 34' ' ' LEU . 72.8 Cg_endo -82.3 -177.46 3.49 Favored 'Trans proline' 0 C--N 1.364 1.365 0 CA-C-N 121.169 1.453 . . . . 0.0 112.676 -179.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -140.67 164.34 30.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.381 -179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -133.7 124.79 3.74 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.094 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.13 -99.81 2.52 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.566 -0.826 . . . . 0.0 111.76 -179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.277 179.261 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.506 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.067 -0.413 . . . . 0.0 112.067 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.436 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 3.8 mm? -61.04 -54.81 50.55 Favored Pre-proline 0 N--CA 1.466 0.367 0 CA-C-O 119.198 -0.43 . . . . 0.0 111.467 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.436 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 76.4 Cg_exo -44.17 -45.01 12.4 Favored 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 122.987 2.458 . . . . 0.0 112.906 -179.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -61.86 -35.62 78.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.14 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.533 HG11 HG22 ' A' ' 5' ' ' VAL . 60.8 t -65.47 -48.92 81.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.335 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.479 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.53 -29.35 68.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.788 179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.613 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 50.6 m -69.28 -23.97 63.9 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.715 0.769 . . . . 0.0 109.461 178.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 66.5 tp -76.0 -21.96 56.34 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.642 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.675 ' O ' HG12 ' B' ' 52' ' ' VAL . 8.2 mmm180 -67.07 -33.96 76.64 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.613 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -71.68 -47.0 57.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.09 -0.959 . . . . 0.0 109.861 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -64.56 -28.11 69.41 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.062 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.675 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.0 OUTLIER -76.95 -36.82 25.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.953 -178.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.519 ' HA ' ' HG2' ' B' ' 56' ' ' GLN . 47.8 mt-10 -70.57 -28.1 64.64 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 122.017 0.913 . . . . 0.0 108.551 176.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -65.22 -51.58 60.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.07 177.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.617 HD11 HG11 ' C' ' 99' ' ' VAL . 25.9 tp -60.19 -40.13 88.95 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.25 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.519 ' HG2' ' HA ' ' B' ' 53' ' ' GLU . 16.9 pt20 -70.68 -23.29 62.46 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.438 179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.575 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.43 -29.1 72.96 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.536 -1.025 . . . . 0.0 110.536 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.669 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 10.5 mm100 -73.01 -42.44 63.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.112 0.482 . . . . 0.0 110.062 178.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.534 ' O ' ' HG2' ' B' ' 63' ' ' GLN . 3.5 t -66.62 -42.11 89.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.344 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.575 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 9.2 pt20 -62.41 -41.85 98.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.07 -179.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.474 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.7 p-80 -78.76 -17.23 56.13 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.137 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.669 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.5 mt -72.98 -46.5 51.93 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 177.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.755 ' HA ' ' HB2' ' B' ' 66' ' ' PHE . 12.7 pt20 -71.76 -22.14 61.64 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -62.42 -51.44 67.51 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 177.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.625 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.34 -41.68 98.9 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.498 177.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.755 ' HB2' ' HA ' ' B' ' 63' ' ' GLN . 0.0 OUTLIER -51.94 -29.28 19.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 114.669 -1.151 . . . . 0.0 111.517 179.058 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 41.8 t -47.89 -34.71 9.3 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.862 0.363 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.867 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 66.9 mt-30 -85.45 -50.54 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.2 0.524 . . . . 0.0 110.841 178.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.689 ' HA ' ' CG2' ' B' ' 72' ' ' VAL . 15.9 m-85 -64.89 -20.62 66.53 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -177.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.447 ' HD2' ' CE2' ' A' ' 29' ' ' TYR . 10.2 mmmm -65.05 -32.24 73.86 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.117 0.484 . . . . 0.0 110.419 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.867 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -108.07 36.74 2.67 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.6 0.714 . . . . 0.0 110.637 179.08 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.689 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 6.6 t -96.51 -43.2 12.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.549 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.466 ' HB2' HG22 ' A' ' 32' ' ' VAL . 34.4 tt0 -105.11 100.83 10.41 Favored 'General case' 0 CA--C 1.502 -0.866 0 CA-C-O 122.031 0.92 . . . . 0.0 110.866 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.906 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -173.11 -39.97 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.404 -1.726 . . . . 0.0 111.29 -179.568 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.906 ' H ' HD23 ' B' ' 74' ' ' LEU . 4.9 p90 -97.33 -24.52 0.23 Allowed Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 178.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.624 ' HD2' ' H ' ' B' ' 74' ' ' LEU . 72.8 Cg_endo -83.03 -177.59 3.41 Favored 'Trans proline' 0 C--N 1.366 1.451 0 CA-C-N 121.317 1.506 . . . . 0.0 112.887 -179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.84 161.49 37.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.44 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -130.33 127.36 5.27 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.823 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 92.33 -99.97 2.61 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.121 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.444 -0.789 . . . . 0.0 110.422 179.439 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.473 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.488 2.122 0 N-CA-C 112.367 -0.293 . . . . 0.0 112.367 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.432 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 3.8 mm? -60.67 -54.77 51.38 Favored Pre-proline 0 CA--C 1.534 0.346 0 CA-C-O 119.334 -0.365 . . . . 0.0 111.46 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.432 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 67.9 Cg_exo -43.76 -44.72 11.43 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 123.033 2.489 . . . . 0.0 112.913 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -62.14 -36.47 81.89 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.354 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.549 HG22 HG11 ' A' ' 5' ' ' VAL . 73.7 t -65.03 -48.12 85.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.205 179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.452 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.18 -29.84 68.81 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.832 179.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 50.1 m -69.19 -22.76 63.88 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.874 0.845 . . . . 0.0 109.22 178.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.619 ' O ' HG22 ' C' ' 92' ' ' VAL . 67.1 tp -76.15 -23.02 54.78 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.713 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.51 ' HA ' ' CG2' ' C' ' 92' ' ' VAL . 8.5 mmm180 -67.51 -31.88 72.31 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.664 0.745 . . . . 0.0 109.032 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -72.51 -45.2 60.51 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.482 -0.781 . . . . 0.0 108.949 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 7.8 tt0 -65.07 -29.31 70.18 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.257 179.216 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.619 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.14 -42.18 58.66 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.91 179.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.505 ' HA ' ' HG2' ' C' ' 96' ' ' GLN . 47.1 mt-10 -65.0 -29.52 70.45 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -65.13 -52.89 52.52 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.541 -1.209 . . . . 0.0 110.408 177.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 16' ' ' GLN . 28.4 tp -60.22 -39.93 88.38 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.325 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.54 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 18.1 pt20 -71.92 -22.29 61.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.408 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.595 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -69.59 -27.83 72.95 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.104 -1.199 . . . . 0.0 110.104 176.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.655 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 11.2 mm100 -74.63 -44.62 49.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.162 0.506 . . . . 0.0 110.413 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.617 HG11 HD11 ' B' ' 55' ' ' LEU . 0.1 OUTLIER -70.74 -31.96 47.58 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.124 -179.077 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.595 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.8 pt20 -67.04 -42.45 84.82 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.716 -0.394 . . . . 0.0 110.707 177.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.465 ' O ' ' HB3' ' C' ' 104' ' ' ALA . 7.6 p-80 -77.45 -17.53 58.0 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.234 -0.986 . . . . 0.0 110.592 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 8.4 mt -71.81 -47.06 55.9 Favored 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.706 ' HA ' ' HB2' ' C' ' 106' ' ' PHE . 14.3 pt20 -70.99 -22.75 62.14 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 177.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -61.68 -51.99 66.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.639 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -63.31 -41.64 98.95 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.706 ' HB2' ' HA ' ' C' ' 103' ' ' GLN . 0.0 OUTLIER -51.77 -29.32 18.42 Favored 'General case' 0 C--O 1.214 -0.781 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.411 178.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 46.4 t -47.75 -34.67 8.71 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.831 0.348 . . . . 0.0 111.124 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.86 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 69.4 mt-30 -85.23 -50.99 6.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.51 0.672 . . . . 0.0 110.665 178.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.668 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 16.1 m-85 -64.5 -21.58 66.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.136 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.488 ' HD2' ' CE2' ' B' ' 69' ' ' TYR . 10.4 mmmm -65.16 -30.25 71.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.075 0.464 . . . . 0.0 110.442 179.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.86 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -109.75 36.94 2.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.523 0.678 . . . . 0.0 110.446 179.204 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.668 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 5.8 t -97.22 -43.72 12.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.663 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.53 ' C ' ' HG ' ' C' ' 114' ' ' LEU . 35.8 tt0 -104.73 100.66 10.3 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 122.252 1.025 . . . . 0.0 110.725 179.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.657 HD12 ' H ' ' C' ' 115' ' ' PHE . 0.1 OUTLIER -170.51 -46.1 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 113.051 -1.886 . . . . 0.0 110.491 -179.087 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.657 ' H ' HD12 ' C' ' 114' ' ' LEU . 4.3 p90 -92.83 -25.67 0.27 Allowed Pre-proline 0 CA--C 1.545 0.772 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -179.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.602 ' HD2' ' H ' ' C' ' 114' ' ' LEU . 78.5 Cg_endo -82.71 -177.5 3.43 Favored 'Trans proline' 0 C--N 1.36 1.169 0 CA-C-N 121.516 1.577 . . . . 0.0 112.822 -179.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -141.38 162.17 36.14 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.614 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -130.86 124.07 4.06 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.259 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 94.79 -100.48 2.58 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.855 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.616 -0.707 . . . . 0.0 109.61 179.081 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.965 0 N-CA-C 111.819 -0.512 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.701 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 3.5 mm? -100.95 -55.25 0.14 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 119.713 -0.184 . . . . 0.0 111.297 179.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.701 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 6.2 Cg_exo -46.13 -45.31 18.27 Favored 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.29 2.66 . . . . 0.0 113.567 -177.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -64.79 -27.34 68.82 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.816 -0.175 . . . . 0.0 111.203 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.46 ' O ' ' HD3' ' A' ' 9' ' ' ARG . 74.4 t -70.49 -46.2 71.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.643 ' O ' ' HB2' ' A' ' 9' ' ' ARG . . . -71.22 -24.81 62.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.122 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.656 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -73.49 -18.58 61.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.67 0.748 . . . . 0.0 109.618 178.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.407 HD22 ' HE ' ' B' ' 49' ' ' ARG . 60.0 tp -79.03 -18.81 52.9 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.008 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.729 ' O ' HG12 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -70.79 -44.33 66.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.219 177.856 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.2 pt20 -70.8 -33.91 71.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.007 0.432 . . . . 0.0 109.946 178.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.425 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 40.9 tt0 -69.86 -31.22 68.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.457 0.646 . . . . 0.0 110.391 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.729 HG12 ' O ' ' A' ' 9' ' ' ARG . 1.4 p -79.3 -31.47 14.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.154 -179.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.509 ' HG3' ' O ' ' A' ' 9' ' ' ARG . 46.3 mt-10 -76.06 -20.47 57.72 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 176.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -70.06 -51.62 30.51 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.284 178.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.0 tp -63.16 -30.48 71.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.972 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.567 ' HA ' HD21 ' C' ' 95' ' ' LEU . 13.0 tt0 -64.4 -40.49 95.89 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.53 177.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.645 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -63.44 -27.39 70.75 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.424 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 12.6 mm100 -71.51 -42.34 68.12 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.947 0.403 . . . . 0.0 110.047 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.457 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 2.4 t -70.88 -37.61 69.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.775 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.645 ' HG2' ' HA2' ' A' ' 17' ' ' GLY . 15.3 pt20 -64.37 -40.99 96.93 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.818 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.537 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -80.12 -17.48 52.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.316 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.731 HD21 ' HG2' ' B' ' 63' ' ' GLN . 7.0 mt -71.43 -38.44 71.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 176.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.689 ' HG2' HD21 ' C' ' 102' ' ' LEU . 66.6 mt-30 -73.78 -27.5 61.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -59.7 -56.79 17.42 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.099 178.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.646 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.33 -43.89 97.76 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.142 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -53.42 -26.09 18.47 Favored 'General case' 0 C--O 1.211 -0.946 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.975 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.1 t -53.98 -36.89 63.4 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.647 0.261 . . . . 0.0 111.446 -179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.614 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 24.7 pt20 -87.45 -36.48 17.67 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.103 179.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.741 ' OH ' ' HD2' ' B' ' 70' ' ' LYS . 26.5 m-85 -73.66 -20.41 60.57 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.439 0.638 . . . . 0.0 110.906 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.697 ' HD2' ' OH ' ' C' ' 109' ' ' TYR . 35.2 tptt -64.56 -40.32 95.35 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.172 179.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.629 ' HE3' ' OE2' ' B' ' 73' ' ' GLU . 0.0 OUTLIER -95.38 31.48 1.96 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.684 0.754 . . . . 0.0 110.524 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.549 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 9.4 t -95.45 -41.27 11.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.062 179.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.556 ' OE2' ' HE3' ' C' ' 111' ' ' LYS . 16.8 tt0 -102.62 103.45 13.74 Favored 'General case' 0 CA--C 1.505 -0.773 0 CA-C-O 122.177 0.989 . . . . 0.0 110.464 178.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.787 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -171.8 -32.38 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 112.942 -1.935 . . . . 0.0 110.292 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.787 ' H ' HD23 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -124.59 23.29 0.11 Allowed Pre-proline 0 CA--C 1.554 1.124 0 N-CA-C 114.238 1.199 . . . . 0.0 114.238 177.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.736 ' HD3' ' H ' ' A' ' 34' ' ' LEU . 61.8 Cg_endo -89.34 -168.16 0.31 Allowed 'Trans proline' 0 C--N 1.367 1.536 0 CA-C-N 121.472 1.561 . . . . 0.0 113.037 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -90.73 28.9 1.42 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.168 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.18 136.55 17.65 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.143 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -101.69 132.69 11.06 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.161 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 10.3 tt . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.484 -0.769 . . . . 0.0 110.093 179.764 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 112.17 -0.372 . . . . 0.0 112.17 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.669 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 3.5 mm? -97.11 -54.06 0.21 Allowed Pre-proline 0 N--CA 1.466 0.371 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.669 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 5.1 Cg_exo -47.12 -44.78 22.94 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.278 2.652 . . . . 0.0 113.517 -177.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -66.16 -25.03 66.76 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.472 0.177 . . . . 0.0 111.292 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.483 ' O ' ' HD3' ' B' ' 49' ' ' ARG . 82.2 t -72.15 -46.06 59.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.647 ' O ' ' HB2' ' B' ' 49' ' ' ARG . . . -71.29 -23.92 62.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.025 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.633 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 67.9 m -74.52 -18.56 60.58 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.6 0.714 . . . . 0.0 109.74 178.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.493 HD22 ' HE ' ' C' ' 89' ' ' ARG . 61.3 tp -79.36 -18.27 52.79 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.713 ' O ' HG12 ' B' ' 52' ' ' VAL . 0.2 OUTLIER -70.75 -44.27 67.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.212 177.773 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.4 pt20 -70.91 -34.84 71.95 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 178.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 40.1 tt0 -68.88 -30.79 69.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.565 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.713 HG12 ' O ' ' B' ' 49' ' ' ARG . 1.5 p -79.67 -32.23 14.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.233 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' B' ' 49' ' ' ARG . 46.1 mt-10 -75.54 -20.17 58.86 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 176.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -70.13 -51.88 27.96 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-N 114.792 -1.094 . . . . 0.0 109.156 177.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.582 HD21 ' HB3' ' C' ' 95' ' ' LEU . 23.0 tp -63.09 -30.29 71.48 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.989 178.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -64.0 -39.83 94.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.572 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.637 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -64.39 -26.89 71.0 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.733 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.664 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 12.2 mm100 -72.03 -42.7 66.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.062 0.458 . . . . 0.0 110.0 179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.473 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.4 t -69.97 -37.96 74.07 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.782 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.637 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -64.53 -41.76 96.17 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.013 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.53 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 7.9 p-80 -78.9 -17.32 55.74 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 119.557 -0.857 . . . . 0.0 110.328 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.723 HD21 ' HG2' ' C' ' 103' ' ' GLN . 7.0 mt -71.88 -38.43 70.02 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 176.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.731 ' HG2' HD21 ' A' ' 22' ' ' LEU . 63.9 mt-30 -73.98 -26.51 60.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -61.07 -55.96 26.5 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.09 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.648 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.82 -44.98 94.72 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.042 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.416 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -52.46 -25.94 11.46 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.893 179.211 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 28.2 t -54.61 -35.62 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 117.748 0.249 . . . . 0.0 111.44 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' B' ' 65' ' ' ALA . 24.0 pt20 -88.74 -36.4 16.15 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 121.055 -0.258 . . . . 0.0 111.039 179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.742 ' OH ' ' HD2' ' C' ' 110' ' ' LYS . 27.0 m-85 -73.79 -19.96 60.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.304 0.573 . . . . 0.0 110.761 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.741 ' HD2' ' OH ' ' A' ' 29' ' ' TYR . 32.8 tptt -64.55 -41.23 96.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.933 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.608 ' HE3' ' OE2' ' C' ' 113' ' ' GLU . 0.0 OUTLIER -94.53 31.52 1.75 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.433 0.635 . . . . 0.0 110.775 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 9.3 t -95.17 -41.68 12.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.931 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.629 ' OE2' ' HE3' ' A' ' 31' ' ' LYS . 15.1 tt0 -102.46 103.41 13.79 Favored 'General case' 0 CA--C 1.502 -0.891 0 CA-C-O 122.24 1.019 . . . . 0.0 110.658 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.799 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.0 OUTLIER -171.63 -33.04 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 112.811 -1.995 . . . . 0.0 110.114 -179.687 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.799 ' H ' HD23 ' B' ' 74' ' ' LEU . 0.1 OUTLIER -123.79 23.39 0.11 Allowed Pre-proline 0 CA--C 1.552 1.045 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 177.888 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.737 ' HD3' ' H ' ' B' ' 74' ' ' LEU . 54.9 Cg_endo -89.06 -167.39 0.28 Allowed 'Trans proline' 0 C--N 1.364 1.388 0 CA-C-N 121.759 1.664 . . . . 0.0 113.052 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -91.01 27.63 1.79 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.264 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.94 134.18 13.57 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.447 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -100.22 134.85 11.85 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.124 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.272 -0.871 . . . . 0.0 109.948 -179.952 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.655 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 3.4 mm? -97.92 -55.22 0.19 Allowed Pre-proline 0 C--N 1.324 -0.532 0 O-C-N 122.843 -0.21 . . . . 0.0 111.546 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.655 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 6.8 Cg_exo -46.04 -43.85 19.8 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.229 2.619 . . . . 0.0 113.859 -178.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -66.2 -26.82 67.58 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.588 0.218 . . . . 0.0 111.588 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.493 ' O ' ' HD3' ' C' ' 89' ' ' ARG . 84.9 t -70.93 -46.22 69.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.62 ' O ' ' HB2' ' C' ' 89' ' ' ARG . . . -71.84 -24.01 61.62 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.265 178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.662 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 71.1 m -74.9 -18.57 60.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.743 0.783 . . . . 0.0 109.25 178.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.727 ' O ' HG22 ' C' ' 92' ' ' VAL . 57.0 tp -77.63 -19.3 55.71 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 177.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.62 ' HB2' ' O ' ' C' ' 86' ' ' ALA . 0.2 OUTLIER -71.32 -42.71 68.24 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.649 178.272 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.3 pt20 -70.95 -33.52 70.55 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 38.8 tt0 -68.82 -33.49 73.92 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.238 178.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.727 HG22 ' O ' ' C' ' 88' ' ' LEU . 0.0 OUTLIER -73.82 -38.52 50.75 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.716 0 C-N-CA 120.144 -0.622 . . . . 0.0 109.913 178.243 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.534 ' HG3' ' O ' ' C' ' 89' ' ' ARG . 42.0 mt-10 -68.49 -21.56 64.6 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 109.068 -0.715 . . . . 0.0 109.068 179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -69.96 -52.54 23.55 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.208 177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.582 ' HB3' HD21 ' B' ' 55' ' ' LEU . 0.3 OUTLIER -60.66 -33.52 72.94 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-N 115.468 -0.787 . . . . 0.0 108.944 178.128 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -62.66 -40.38 96.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.899 179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.543 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -64.87 -27.19 71.81 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.481 178.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.658 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 12.2 mm100 -71.58 -42.77 67.38 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 178.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.476 ' O ' ' HG3' ' C' ' 103' ' ' GLN . 2.5 t -70.73 -37.17 67.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.543 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 18.3 pt20 -65.25 -40.74 94.39 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.616 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.568 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.6 p-80 -80.42 -17.5 51.6 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 119.652 -0.819 . . . . 0.0 110.296 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.689 HD21 ' HG2' ' A' ' 23' ' ' GLN . 7.2 mt -71.13 -38.53 72.28 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 176.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.723 ' HG2' HD21 ' B' ' 62' ' ' LEU . 63.2 mt-30 -73.87 -27.21 60.96 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.369 -0.974 . . . . 0.0 108.369 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -59.51 -56.96 15.43 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.299 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.638 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.16 -44.45 96.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.155 178.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -52.92 -26.88 16.36 Favored 'General case' 0 C--O 1.212 -0.89 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.022 179.461 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 34.4 t -53.14 -37.84 62.17 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 120.684 0.278 . . . . 0.0 111.194 -179.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' C' ' 105' ' ' ALA . 25.1 pt20 -87.0 -35.9 18.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.368 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.697 ' OH ' ' HD2' ' A' ' 30' ' ' LYS . 28.7 m-85 -74.21 -19.93 60.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.361 0.6 . . . . 0.0 110.85 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.742 ' HD2' ' OH ' ' B' ' 69' ' ' TYR . 32.0 tptt -64.67 -40.8 96.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.994 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.608 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -95.06 31.71 1.83 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.481 0.658 . . . . 0.0 110.753 179.08 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.535 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 10.9 t -95.97 -41.38 11.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.954 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.608 ' OE2' ' HE3' ' B' ' 71' ' ' LYS . 15.7 tt0 -102.52 101.69 11.89 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-O 122.459 1.124 . . . . 0.0 111.221 178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.712 ' H ' ' HD3' ' C' ' 116' ' ' PRO . 0.2 OUTLIER -167.68 -37.98 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 112.651 -2.068 . . . . 0.0 109.723 -179.531 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.628 ' H ' HD12 ' C' ' 114' ' ' LEU . 0.1 OUTLIER -120.93 23.57 0.11 Allowed Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 179.633 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.712 ' HD3' ' H ' ' C' ' 114' ' ' LEU . 66.3 Cg_endo -88.95 -168.82 0.36 Allowed 'Trans proline' 0 C--N 1.362 1.262 0 CA-C-N 121.782 1.672 . . . . 0.0 113.026 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -89.52 28.2 1.33 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.324 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -78.67 135.53 15.9 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.657 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -102.3 131.6 10.66 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.494 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--O 1.249 1.047 0 CA-C-O 117.99 -1.005 . . . . 0.0 109.706 179.632 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.689 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 2.3 mm? -119.8 -61.59 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.756 0.278 . . . . 0.0 111.023 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.689 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 6.2 Cg_endo -53.27 -49.63 16.8 Favored 'Trans proline' 0 C--N 1.358 1.076 0 C-N-CA 123.13 2.553 . . . . 0.0 113.31 -177.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -61.75 -33.97 75.01 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.661 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG22 HG11 ' B' ' 45' ' ' VAL . 90.1 t -69.42 -50.65 49.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.69 179.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.636 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.0 -24.84 64.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.289 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 70.7 m -69.66 -26.18 64.27 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.0 tp -73.59 -23.55 59.95 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.053 178.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.636 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 48.4 mmm-85 -63.45 -23.68 67.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.253 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 7' ' ' SER . 3.4 mt-30 -76.34 -43.21 42.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.522 -179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 52.0 tt0 -70.03 -29.29 66.31 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.454 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 31.9 t -74.6 -36.37 40.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.077 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -66.36 -32.12 73.31 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.505 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -64.98 -56.73 11.42 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.283 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 19' ' ' VAL . 4.6 mp -57.7 -39.08 76.38 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.48 -1.236 . . . . 0.0 112.034 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -70.67 -31.33 68.2 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.1 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.589 ' O ' ' HG3' ' A' ' 20' ' ' GLN . . . -72.72 -31.14 62.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 119.933 -1.127 . . . . 0.0 111.494 178.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 14' ' ' ALA . 77.6 mm-40 -76.37 -35.52 58.63 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 120.806 0.336 . . . . 0.0 110.575 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.584 HG23 ' O ' ' A' ' 15' ' ' LEU . 58.7 t -77.16 -32.03 18.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.729 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.589 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -67.98 -40.12 83.17 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.487 179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.526 ' CE1' HD12 ' A' ' 22' ' ' LEU . 6.8 p-80 -80.44 -25.6 38.86 Favored 'General case' 0 N--CA 1.46 0.049 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.928 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.756 HD11 ' HG3' ' B' ' 63' ' ' GLN . 0.1 OUTLIER -72.87 -39.73 66.22 Favored 'General case' 0 CA--C 1.512 -0.516 0 C-N-CA 120.104 -0.639 . . . . 0.0 109.863 178.475 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.694 ' HG3' HD21 ' C' ' 102' ' ' LEU . 26.6 tt0 -70.71 -36.86 73.44 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.87 -56.61 19.36 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.967 178.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -60.35 -48.21 82.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.77 179.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.775 ' HD2' HD13 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.54 -24.84 22.53 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.064 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.2 t -49.61 -32.2 12.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.64 0.257 . . . . 0.0 111.04 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.429 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 12.9 mm100 -96.3 -45.63 6.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.081 178.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 15.8 m-85 -66.47 -20.08 65.95 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -73.24 -4.4 32.82 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 120.908 0.385 . . . . 0.0 110.868 -179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.609 ' O ' HD11 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -127.76 36.06 4.4 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.983 0.897 . . . . 0.0 108.73 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.569 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 12.8 t -100.58 -34.63 4.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 114.537 -1.211 . . . . 0.0 112.127 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -85.62 81.64 8.57 Favored 'General case' 0 CA--C 1.509 -0.632 0 CA-C-O 122.969 1.366 . . . . 0.0 111.417 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.618 HD12 ' H ' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -163.69 -37.3 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.922 0 CA-C-N 111.95 -2.387 . . . . 0.0 109.539 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.618 ' H ' HD12 ' A' ' 34' ' ' LEU . 0.0 OUTLIER -120.22 38.85 0.33 Allowed Pre-proline 0 CA--C 1.552 1.03 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 179.045 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 35' ' ' PHE . 73.4 Cg_endo -75.33 179.63 5.98 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 121.464 1.443 . . . . 0.0 111.747 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 55.8 t30 -94.07 65.11 3.4 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.322 0.582 . . . . 0.0 109.697 179.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 129.29 -168.34 20.95 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.768 -0.729 . . . . 0.0 111.937 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -147.0 -70.06 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.146 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.8 tp . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.155 179.51 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.971 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.676 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 2.3 mm? -117.82 -62.07 0.03 OUTLIER Pre-proline 0 CA--C 1.533 0.291 0 CA-C-N 117.073 0.437 . . . . 0.0 111.342 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.676 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 5.2 Cg_endo -52.06 -49.07 18.56 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 123.337 2.692 . . . . 0.0 113.679 -177.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -63.21 -31.61 72.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.566 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.416 HG11 HG22 ' A' ' 5' ' ' VAL . 97.7 t -71.3 -50.87 38.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.564 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.654 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -68.84 -25.58 64.72 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.244 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.677 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 73.4 m -69.01 -26.22 64.9 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 55.7 tp -73.1 -23.79 60.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.066 178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.654 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 47.8 mmm-85 -63.81 -21.85 66.63 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.973 0.415 . . . . 0.0 110.215 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' B' ' 47' ' ' SER . 3.8 mt-30 -77.94 -43.68 29.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.287 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.465 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 52.0 tt0 -70.04 -28.31 65.36 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.622 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 26.7 t -74.85 -37.79 42.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.754 178.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 56' ' ' GLN . 88.8 tt0 -65.37 -31.79 73.08 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' B' ' 58' ' ' GLN . . . -65.35 -56.58 11.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.195 -1.366 . . . . 0.0 110.442 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 59' ' ' VAL . 4.7 mp -57.68 -39.23 76.64 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.93 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.459 ' HB3' HD21 ' A' ' 15' ' ' LEU . 19.8 pt20 -70.35 -31.95 69.44 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.087 -179.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.582 ' O ' ' HG3' ' B' ' 60' ' ' GLN . . . -71.98 -30.89 64.98 Favored Glycine 0 C--O 1.238 0.396 0 C-N-CA 120.08 -1.057 . . . . 0.0 111.373 178.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' B' ' 54' ' ' ALA . 77.0 mm-40 -76.58 -36.49 57.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.795 0.331 . . . . 0.0 110.528 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.565 HG23 ' O ' ' B' ' 55' ' ' LEU . 59.9 t -76.28 -31.29 20.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 O-C-N 122.256 -0.278 . . . . 0.0 110.711 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' B' ' 57' ' ' GLY . 0.0 OUTLIER -69.02 -40.51 78.62 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.279 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.548 ' CE1' HD12 ' B' ' 62' ' ' LEU . 6.8 p-80 -80.18 -24.97 39.97 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 119.856 -0.738 . . . . 0.0 111.061 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.673 HD11 ' HG3' ' C' ' 103' ' ' GLN . 0.1 OUTLIER -74.03 -39.5 63.53 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.584 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.756 ' HG3' HD11 ' A' ' 22' ' ' LEU . 23.3 tt0 -69.93 -38.72 76.29 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.57 30.6 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 114.553 -1.203 . . . . 0.0 110.122 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.722 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.51 -48.03 82.9 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.797 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.692 ' HD2' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.65 -24.39 21.45 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 115.322 -0.853 . . . . 0.0 112.286 -179.615 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.0 t -49.96 -31.88 13.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.772 0.32 . . . . 0.0 110.999 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' B' ' 71' ' ' LYS . 12.8 mm100 -96.83 -44.86 6.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.963 0.411 . . . . 0.0 111.096 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.722 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 14.4 m-85 -67.12 -19.69 65.66 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 18.4 pttp -73.57 -4.07 31.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.023 0.439 . . . . 0.0 110.786 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.619 ' O ' HD11 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -127.98 35.89 4.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.782 0.801 . . . . 0.0 109.012 177.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.56 HG23 ' HA ' ' B' ' 69' ' ' TYR . 11.8 t -100.33 -34.97 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.101 -179.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -84.79 80.89 9.11 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-O 123.11 1.434 . . . . 0.0 111.402 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.619 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -163.61 -34.5 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.893 0 CA-C-N 111.978 -2.374 . . . . 0.0 109.926 179.584 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.544 ' H ' HD12 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -123.15 38.59 0.38 Allowed Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.624 0.972 . . . . 0.0 113.624 178.866 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' B' ' 75' ' ' PHE . 71.8 Cg_endo -75.7 177.5 8.61 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.507 1.471 . . . . 0.0 111.738 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -91.78 67.93 5.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.332 0.587 . . . . 0.0 109.731 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 128.63 -164.36 21.83 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.166 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -151.83 -71.6 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.948 -0.644 . . . . 0.0 111.848 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.184 -0.912 . . . . 0.0 109.684 179.509 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.66 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.665 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 5.5 mt -125.45 -61.71 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -179.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.665 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 8.4 Cg_endo -53.09 -46.86 30.88 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.899 2.4 . . . . 0.0 112.808 -179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -63.95 -33.73 76.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.329 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . . . . . . . . . 92.1 t -69.19 -50.99 47.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.7 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.657 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.68 -25.02 64.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.283 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.668 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 73.4 m -69.67 -25.75 64.05 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . . . . . . . . . 54.9 tp -73.77 -23.6 59.74 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.984 178.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.657 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 48.3 mmm-85 -64.21 -21.7 66.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.194 178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' C' ' 87' ' ' SER . 3.8 mt-30 -78.45 -43.47 27.11 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.027 -179.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.485 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 51.8 tt0 -69.42 -29.91 67.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.728 178.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 25.3 t -74.71 -36.14 39.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.819 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -66.03 -31.27 72.06 Favored 'General case' 0 C--O 1.232 0.149 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.512 ' O ' ' HG2' ' C' ' 98' ' ' GLN . . . -66.02 -56.42 11.69 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.301 -1.318 . . . . 0.0 110.249 178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.604 ' O ' HG23 ' C' ' 99' ' ' VAL . 7.3 mt -57.05 -40.33 76.61 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 114.46 -1.245 . . . . 0.0 111.703 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' B' ' 55' ' ' LEU . 20.0 pt20 -70.06 -32.32 70.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.397 -178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.592 ' O ' ' HG3' ' C' ' 100' ' ' GLN . . . -71.62 -31.66 65.09 Favored Glycine 0 C--O 1.239 0.451 0 C-N-CA 120.233 -0.984 . . . . 0.0 111.268 178.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' C' ' 94' ' ' ALA . 77.0 mm-40 -76.2 -34.91 59.28 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.674 0.273 . . . . 0.0 110.706 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.604 HG23 ' O ' ' C' ' 95' ' ' LEU . 60.1 t -77.52 -31.46 17.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.697 179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.592 ' HG3' ' O ' ' C' ' 97' ' ' GLY . 0.0 OUTLIER -68.71 -38.72 80.47 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.324 179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.59 ' CE1' HD23 ' C' ' 102' ' ' LEU . 6.3 p-80 -81.77 -26.41 34.47 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 119.604 -0.839 . . . . 0.0 111.097 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.775 HD13 ' HD2' ' A' ' 26' ' ' PHE . 0.1 OUTLIER -67.54 -47.09 70.88 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.673 ' HG3' HD11 ' B' ' 62' ' ' LEU . 24.2 tt0 -67.51 -38.38 84.21 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.31 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.64 -55.96 25.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.002 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.729 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.01 -47.78 84.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.993 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.646 ' HD2' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -54.93 -24.01 21.66 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.968 -179.432 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 26.2 t -50.44 -31.04 14.0 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.638 0.256 . . . . 0.0 110.841 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' C' ' 111' ' ' LYS . 12.8 mm100 -97.58 -46.0 6.19 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.002 178.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.729 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 15.5 m-85 -65.98 -19.98 66.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . . . . . . . . . 18.6 pttp -72.75 -5.15 35.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.024 0.44 . . . . 0.0 110.856 -179.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.542 ' O ' HD11 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -126.8 35.39 4.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.97 0.891 . . . . 0.0 108.908 177.636 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.594 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 15.8 t -99.4 -34.81 4.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.236 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -85.19 81.43 8.83 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 123.081 1.42 . . . . 0.0 111.427 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.542 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.3 OUTLIER -163.57 -36.87 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 112.029 -2.35 . . . . 0.0 109.62 179.507 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.526 ' H ' HD12 ' C' ' 114' ' ' LEU . 0.0 OUTLIER -120.76 39.3 0.36 Allowed Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 178.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' C' ' 115' ' ' PHE . 72.3 Cg_endo -76.28 178.16 7.86 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 121.623 1.548 . . . . 0.0 111.7 179.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -92.78 67.4 4.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.557 0.694 . . . . 0.0 109.967 179.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 128.59 -164.89 21.65 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.188 -179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.32 -72.59 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.715 179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 9.5 tp . . . . . 0 C--O 1.246 0.903 0 CA-C-O 118.344 -0.836 . . . . 0.0 109.981 179.389 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.723 -0.551 . . . . 0.0 111.723 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.676 ' H ' ' HD2' ' A' ' 3' ' ' PRO . 93.4 mt -115.78 -56.38 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 119.238 -0.411 . . . . 0.0 110.665 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.676 ' HD2' ' H ' ' A' ' 2' ' ' LEU . 51.6 Cg_exo -45.48 -46.22 14.77 Favored 'Trans proline' 0 C--N 1.36 1.134 0 C-N-CA 122.812 2.342 . . . . 0.0 113.496 -178.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -63.61 -29.34 70.6 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.697 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.677 HG22 HG11 ' B' ' 45' ' ' VAL . 45.3 t -67.78 -47.69 78.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.663 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -71.8 -27.0 62.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.393 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 66.2 m -71.0 -17.49 62.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.813 0.816 . . . . 0.0 109.247 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.6 tp -78.21 -21.83 49.46 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.485 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.663 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -69.62 -16.65 63.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.46 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.472 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 9.0 mm-40 -77.87 -40.02 41.45 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.774 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.492 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 3.7 tp-100 -73.24 -25.18 60.62 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.014 178.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.6 t -72.87 -45.92 54.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.651 -1.158 . . . . 0.0 109.8 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -67.53 -26.91 66.56 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -63.07 -54.29 40.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.36 178.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' B' ' 56' ' ' GLN . 13.1 tp -60.86 -32.96 72.37 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.647 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.606 ' HA ' HD11 ' C' ' 95' ' ' LEU . 10.3 tt0 -63.6 -36.42 83.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.33 178.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -61.21 -31.43 76.94 Favored Glycine 0 CA--C 1.518 0.262 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.803 178.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.638 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 71.0 mt-30 -73.98 -47.54 36.59 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.093 0.473 . . . . 0.0 111.213 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.479 HG12 ' HA ' ' A' ' 16' ' ' GLN . 7.6 p -66.48 -36.16 76.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.772 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -65.78 -44.58 85.35 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.122 -0.231 . . . . 0.0 110.869 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.508 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 7.7 p-80 -75.36 -13.76 60.43 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.368 179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 7.1 mt -73.58 -34.69 65.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 176.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm-40 -68.29 -35.41 77.8 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 176.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.41 -50.69 72.18 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.531 178.056 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.716 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.79 -42.46 99.02 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.056 178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.54 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 6.6 m-85 -56.27 -27.28 54.71 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.71 179.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.1 t -54.63 -27.13 37.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.164 0.507 . . . . 0.0 110.606 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 87.4 mm-40 -94.68 -37.6 11.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.607 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.716 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 37.7 m-85 -77.98 -18.81 55.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.789 0.328 . . . . 0.0 111.481 -179.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.54 ' HB2' ' O ' ' A' ' 26' ' ' PHE . 4.2 tmtt? -58.04 -49.88 75.35 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.42 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.729 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.2 OUTLIER -88.77 39.46 0.92 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 122.206 1.003 . . . . 0.0 110.501 179.46 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.711 HG13 ' HG3' ' B' ' 76' ' ' PRO . 51.4 t -125.1 -10.55 5.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.673 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.582 ' HA ' HG21 ' C' ' 112' ' ' VAL . 10.8 pt-20 -75.45 -35.19 60.95 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -64.22 -76.73 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.862 0.839 . . . . 0.0 112.732 -177.488 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.469 ' H ' ' HB2' ' A' ' 34' ' ' LEU . 42.3 m-85 -32.54 -50.02 0.57 Allowed Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 117.656 2.465 . . . . 0.0 117.656 -176.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.707 ' HG3' HG13 ' C' ' 112' ' ' VAL . 66.2 Cg_endo -75.69 17.12 0.7 Allowed 'Trans proline' 0 N--CA 1.473 0.29 0 C-N-CA 121.818 1.679 . . . . 0.0 114.548 -177.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -101.31 103.67 14.65 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -62.85 -31.03 78.97 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 121.121 -0.562 . . . . 0.0 113.608 -178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 89.09 34.08 9.1 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.364 -0.922 . . . . 0.0 111.945 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.386 -0.816 . . . . 0.0 109.174 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.024 0 N-CA-C 111.818 -0.513 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.632 ' H ' ' HD2' ' B' ' 43' ' ' PRO . 95.6 mt -114.91 -57.04 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.411 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.834 179.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.632 ' HD2' ' H ' ' B' ' 42' ' ' LEU . 50.7 Cg_exo -44.8 -46.01 13.09 Favored 'Trans proline' 0 C--N 1.363 1.337 0 C-N-CA 123.099 2.533 . . . . 0.0 113.31 -178.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -63.44 -29.42 70.71 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.638 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.677 HG11 HG22 ' A' ' 5' ' ' VAL . 41.8 t -68.69 -47.49 76.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.292 -0.632 . . . . 0.0 109.292 178.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.659 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.27 -25.84 61.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.34 178.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 68.2 m -71.74 -17.56 62.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.933 0.873 . . . . 0.0 109.429 178.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 61.4 tp -78.02 -22.68 48.87 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.269 178.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 0.3 OUTLIER -68.85 -15.57 63.53 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 178.444 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . . . . . . . . . 8.5 mm-40 -79.57 -39.34 31.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.767 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 3.8 tp-100 -74.16 -25.04 59.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.833 0.825 . . . . 0.0 109.037 178.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.5 t -72.89 -45.66 54.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.7 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -68.04 -26.58 65.94 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -63.89 -52.97 57.45 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.518 178.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.608 HD11 ' HA ' ' C' ' 96' ' ' GLN . 13.3 tp -62.11 -32.36 72.92 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.632 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.576 ' HA ' HD11 ' A' ' 15' ' ' LEU . 9.0 tt0 -64.31 -35.73 81.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.803 -1.09 . . . . 0.0 110.219 178.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.422 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -61.71 -31.28 77.45 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.84 178.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.618 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 71.3 mt-30 -73.88 -47.77 35.75 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.035 0.445 . . . . 0.0 110.982 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.488 HG12 ' HA ' ' B' ' 56' ' ' GLN . 7.5 p -66.27 -36.23 76.87 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.6 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 17.4 pt20 -65.64 -44.47 86.3 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.141 -0.224 . . . . 0.0 110.664 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.514 ' HD1' ' HA ' ' B' ' 58' ' ' GLN . 7.5 p-80 -75.59 -13.46 60.34 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.651 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 7.3 mt -74.22 -35.09 63.88 Favored 'General case' 0 CA--C 1.516 -0.333 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -67.79 -35.6 78.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.06 -51.4 69.42 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.508 -1.223 . . . . 0.0 109.378 177.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.724 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -60.63 -43.41 97.56 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.884 178.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.547 ' O ' ' HB2' ' B' ' 70' ' ' LYS . 7.4 m-85 -55.53 -28.24 53.6 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.679 179.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 32.7 t -53.66 -27.41 27.32 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.249 0.547 . . . . 0.0 110.775 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.707 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 89.6 mm-40 -94.64 -38.65 10.73 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.496 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.724 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 36.0 m-85 -77.04 -18.58 58.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.919 0.39 . . . . 0.0 111.675 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.547 ' HB2' ' O ' ' B' ' 66' ' ' PHE . 4.5 tmtt? -58.77 -49.08 78.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.363 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER -89.25 39.65 0.95 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.989 0.899 . . . . 0.0 110.363 179.365 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.668 HG13 ' HG3' ' C' ' 116' ' ' PRO . 55.6 t -125.66 -9.87 5.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.734 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.611 ' HG3' HD13 ' B' ' 74' ' ' LEU . 12.1 pt-20 -76.27 -34.24 59.12 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.875 ' H ' HD22 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -65.42 -75.96 0.08 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 121.909 0.862 . . . . 0.0 112.972 -177.526 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.425 ' H ' ' HB2' ' B' ' 74' ' ' LEU . 42.6 m-85 -33.01 -50.14 0.63 Allowed Pre-proline 0 N--CA 1.476 0.853 0 N-CA-C 117.5 2.407 . . . . 0.0 117.5 -176.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.711 ' HG3' HG13 ' A' ' 32' ' ' VAL . 67.8 Cg_endo -76.14 19.21 0.61 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.214 1.943 . . . . 0.0 114.359 -177.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -103.95 104.5 14.48 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.24 -36.33 92.86 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.238 -0.506 . . . . 0.0 113.209 -178.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 94.72 31.24 7.91 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.546 -0.835 . . . . 0.0 111.582 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.292 -0.861 . . . . 0.0 109.79 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.921 0 N-CA-C 112.07 -0.412 . . . . 0.0 112.07 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.682 ' H ' ' HD2' ' C' ' 83' ' ' PRO . 93.1 mt -116.49 -56.24 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 119.522 -0.275 . . . . 0.0 110.633 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.682 ' HD2' ' H ' ' C' ' 82' ' ' LEU . 52.3 Cg_exo -45.49 -46.5 14.44 Favored 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.831 2.354 . . . . 0.0 113.153 -179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -63.1 -29.44 70.81 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.856 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.641 HG22 HG11 ' A' ' 5' ' ' VAL . 40.2 t -68.02 -47.85 77.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 178.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.679 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.15 -26.27 62.03 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.464 . . . . 0.0 110.414 178.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . . . . . . . . . 70.6 m -70.7 -17.65 62.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.917 0.865 . . . . 0.0 109.415 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.673 ' O ' HG13 ' C' ' 92' ' ' VAL . 53.1 tp -79.23 -22.99 44.03 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.601 -0.84 . . . . 0.0 110.654 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.679 ' HG2' ' O ' ' C' ' 86' ' ' ALA . 0.1 OUTLIER -69.79 -12.56 61.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.459 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.433 ' H ' ' HG2' ' C' ' 90' ' ' GLN . 0.4 OUTLIER -81.62 -37.44 27.57 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.742 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.427 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 3.3 tp-100 -75.01 -27.11 59.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.906 177.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.673 HG13 ' O ' ' C' ' 88' ' ' LEU . 1.5 m -75.76 -38.08 36.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 119.396 -0.922 . . . . 0.0 109.561 179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -68.38 -27.87 66.62 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -63.99 -52.41 59.73 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.15 178.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.606 HD11 ' HA ' ' A' ' 16' ' ' GLN . 13.1 tp -61.47 -33.46 73.8 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.738 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.608 ' HA ' HD11 ' B' ' 55' ' ' LEU . 10.6 tt0 -63.54 -35.72 81.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.391 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.427 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -61.5 -31.64 78.31 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.93 -0.652 . . . . 0.0 111.755 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.629 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 64.0 mt-30 -74.05 -47.37 37.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.097 0.475 . . . . 0.0 111.137 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.516 HG12 ' HA ' ' C' ' 96' ' ' GLN . 7.6 p -66.53 -35.58 75.2 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 C-N-CA 120.687 -0.405 . . . . 0.0 111.811 -179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.458 ' HG2' ' O ' ' C' ' 96' ' ' GLN . 16.4 pt20 -66.35 -44.29 83.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.951 179.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.549 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 8.7 p-80 -75.88 -13.46 60.27 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.154 -1.018 . . . . 0.0 110.07 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.629 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 6.2 mt -72.93 -35.84 67.11 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 176.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -67.3 -36.03 80.68 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 176.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -56.46 -51.38 68.64 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 114.368 -1.287 . . . . 0.0 109.621 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.72 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.23 -42.81 99.26 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.291 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.577 ' O ' ' HB2' ' C' ' 110' ' ' LYS . 15.6 m-85 -56.05 -27.88 55.21 Favored 'General case' 0 C--O 1.214 -0.816 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.563 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 24.1 t -52.99 -26.45 15.32 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.151 0.5 . . . . 0.0 110.694 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.75 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 91.2 mm-40 -96.49 -37.75 10.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.72 ' HE2' ' HB1' ' C' ' 105' ' ' ALA . 37.0 m-85 -78.32 -18.95 54.49 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.997 0.427 . . . . 0.0 111.494 -179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' C' ' 106' ' ' PHE . 3.7 tmtt? -58.79 -47.39 84.89 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.598 -179.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.75 ' HE2' ' HA ' ' C' ' 108' ' ' GLN . 0.2 OUTLIER -90.47 38.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 122.095 0.95 . . . . 0.0 110.138 178.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.707 HG13 ' HG3' ' A' ' 36' ' ' PRO . 53.6 t -124.48 -10.37 6.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.813 -179.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.58 ' HA ' HG21 ' B' ' 72' ' ' VAL . 10.4 pt-20 -75.37 -36.4 60.95 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -179.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.886 HD22 ' H ' ' C' ' 114' ' ' LEU . 0.2 OUTLIER -63.18 -76.3 0.07 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.979 0.895 . . . . 0.0 113.023 -177.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.446 ' H ' ' HB2' ' C' ' 114' ' ' LEU . 41.4 m-85 -32.67 -50.95 0.61 Allowed Pre-proline 0 N--CA 1.477 0.889 0 N-CA-C 117.39 2.367 . . . . 0.0 117.39 -176.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.668 ' HG3' HG13 ' B' ' 72' ' ' VAL . 55.7 Cg_endo -74.74 18.34 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.156 1.904 . . . . 0.0 114.708 -177.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 t30 -103.59 103.66 13.62 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.6 -33.76 87.53 Favored Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 116.118 -0.492 . . . . 0.0 113.347 -178.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 92.2 31.9 8.73 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.141 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.468 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.433 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.879 -0.488 . . . . 0.0 111.879 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.5 ' HB2' ' HD3' ' A' ' 3' ' ' PRO . 0.9 OUTLIER -58.46 -54.51 55.28 Favored Pre-proline 0 N--CA 1.47 0.546 0 CA-C-N 116.967 0.383 . . . . 0.0 111.208 179.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HD3' ' HB2' ' A' ' 2' ' ' LEU . 54.0 Cg_exo -45.44 -40.91 17.95 Favored 'Trans proline' 0 C--N 1.359 1.098 0 C-N-CA 122.804 2.336 . . . . 0.0 113.01 -179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -69.58 -22.43 63.53 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.9 -179.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.436 ' O ' ' HB3' ' A' ' 8' ' ' LEU . 90.2 t -68.38 -48.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.958 0.409 . . . . 0.0 110.196 179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.971 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -72.99 -25.77 61.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.832 179.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.695 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 67.7 m -71.69 -22.31 61.67 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.463 ' HA ' ' HG2' ' A' ' 11' ' ' GLN . 62.1 tp -78.92 -26.3 43.69 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.799 177.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.971 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -64.23 -49.0 73.68 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 178.491 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 7' ' ' SER . 2.4 pt20 -61.99 -48.5 80.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.108 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 8' ' ' LEU . 15.8 pt20 -68.41 -21.24 64.69 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.198 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 2.3 t -77.36 -34.92 21.53 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.405 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.771 ' HA ' HE21 ' A' ' 16' ' ' GLN . 48.9 mt-10 -70.1 -28.03 65.08 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -64.91 -58.57 5.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.311 -1.313 . . . . 0.0 110.177 178.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -62.01 -36.28 81.07 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.703 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.771 HE21 ' HA ' ' A' ' 13' ' ' GLU . 9.4 pt20 -71.06 -22.3 62.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.578 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.682 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -69.05 -32.8 73.35 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.056 -1.068 . . . . 0.0 110.655 178.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 54.1 mt-30 -72.65 -49.85 29.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.322 -0.439 . . . . 0.0 110.47 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.708 ' HB ' HG21 ' B' ' 59' ' ' VAL . 2.9 p -67.42 -28.71 43.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 C-N-CA 120.217 -0.593 . . . . 0.0 111.833 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.682 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 13.2 pt20 -67.38 -43.93 80.2 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.2 p-80 -77.73 -18.34 56.64 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.139 179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.763 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 44.9 mt -72.24 -40.27 67.85 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.592 ' HB2' HD11 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -70.79 -36.85 73.22 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -54.87 41.8 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 114.544 -1.207 . . . . 0.0 110.098 178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.736 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.58 -44.39 97.1 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.402 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.688 ' HD2' HD22 ' C' ' 102' ' ' LEU . 0.0 OUTLIER -54.93 -26.53 36.75 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.422 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -50.15 -24.79 2.98 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.045 0.45 . . . . 0.0 110.88 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.717 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 99.0 mm-40 -102.27 -41.09 6.48 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.375 177.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.736 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 38.5 m-85 -73.28 -19.59 61.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -178.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.469 ' HG3' ' O ' ' A' ' 26' ' ' PHE . 43.1 mtmt -69.95 -8.86 52.33 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.855 0.359 . . . . 0.0 110.726 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.717 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -127.81 37.05 4.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.74 0.781 . . . . 0.0 109.78 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.621 HG23 ' HA ' ' A' ' 29' ' ' TYR . 8.2 t -100.95 -43.27 10.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.134 179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.492 ' C ' ' HG ' ' A' ' 34' ' ' LEU . 31.9 tt0 -87.4 88.92 7.81 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 122.613 1.196 . . . . 0.0 111.259 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.587 HD11 ' O ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -163.1 -39.96 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 112.826 -1.988 . . . . 0.0 109.552 179.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.835 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 83.7 m-85 -55.45 -59.87 9.97 Favored Pre-proline 0 N--CA 1.471 0.599 0 CA-C-N 116.243 -0.435 . . . . 0.0 109.881 178.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.835 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 71.4 Cg_endo -85.69 -178.04 2.82 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 122.42 2.08 . . . . 0.0 111.834 178.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -93.67 94.16 8.43 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.79 -15.1 78.5 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.38 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.74 80.86 1.71 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.551 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.9 mm . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.253 -0.879 . . . . 0.0 109.796 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.635 ' HA2' HD22 ' C' ' 82' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.861 0 N-CA-C 111.746 -0.542 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.483 ' HB2' ' HD3' ' B' ' 43' ' ' PRO . 0.9 OUTLIER -57.81 -54.75 52.1 Favored Pre-proline 0 N--CA 1.469 0.52 0 CA-C-N 117.174 0.487 . . . . 0.0 111.239 179.367 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.483 ' HD3' ' HB2' ' B' ' 42' ' ' LEU . 50.1 Cg_exo -45.84 -39.56 19.07 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.568 2.179 . . . . 0.0 112.961 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -70.57 -23.43 62.6 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.506 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LEU . 96.6 t -67.24 -49.38 72.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.35 179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.995 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -72.36 -25.6 61.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.869 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.682 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 66.4 m -71.86 -21.92 61.6 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.457 ' HA ' ' HG2' ' B' ' 51' ' ' GLN . 62.3 tp -79.29 -26.46 42.3 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.434 177.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.995 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 0.7 OUTLIER -63.34 -49.46 73.84 Favored 'General case' 0 N--CA 1.461 0.106 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.25 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' B' ' 47' ' ' SER . 2.5 pt20 -62.21 -48.25 80.82 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.295 -179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.457 ' HG2' ' HA ' ' B' ' 48' ' ' LEU . 15.9 pt20 -68.21 -21.64 64.84 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 120.145 -0.622 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.05 -34.79 22.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 178.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.807 ' HA ' HE21 ' B' ' 56' ' ' GLN . 48.4 mt-10 -69.54 -30.13 67.88 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 177.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -62.99 -59.12 5.25 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.37 -1.286 . . . . 0.0 110.521 178.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -61.6 -35.47 77.96 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.611 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.807 HE21 ' HA ' ' B' ' 53' ' ' GLU . 9.2 pt20 -71.57 -22.21 61.77 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.769 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.696 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -68.9 -33.97 76.14 Favored Glycine 0 N--CA 1.452 -0.279 0 N-CA-C 110.414 -1.074 . . . . 0.0 110.414 178.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.771 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 55.5 mt-30 -71.48 -48.95 45.87 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.069 0.461 . . . . 0.0 110.575 179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.711 ' HB ' HG11 ' C' ' 99' ' ' VAL . 2.9 p -68.77 -28.05 38.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.814 -178.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.696 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 13.3 pt20 -67.7 -43.26 80.52 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.123 -0.231 . . . . 0.0 110.439 178.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -78.31 -19.11 54.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 119.896 -0.722 . . . . 0.0 109.991 179.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.771 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 50.7 mt -71.55 -40.73 69.84 Favored 'General case' 0 CA--C 1.515 -0.395 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 177.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.597 ' HB2' HD11 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -70.29 -37.34 74.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.791 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.45 -55.33 35.04 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.149 178.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.691 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -61.18 -44.75 96.8 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.377 179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.696 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -54.84 -26.5 35.63 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.336 -179.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -48.9 -27.49 3.13 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.984 0.421 . . . . 0.0 110.595 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.758 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 96.7 mm-40 -99.92 -41.14 7.34 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.725 178.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.691 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 38.6 m-85 -72.85 -19.83 61.23 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' B' ' 66' ' ' PHE . 41.5 mtmt -69.5 -8.34 46.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.67 0.271 . . . . 0.0 110.745 179.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.758 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -129.44 38.12 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.133 0.968 . . . . 0.0 109.782 178.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.633 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 10.4 t -101.61 -43.57 10.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.809 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.531 ' OE1' ' HB3' ' A' ' 28' ' ' GLN . 31.4 tt0 -87.68 89.38 7.97 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 122.742 1.258 . . . . 0.0 111.314 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.585 HD11 ' O ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER -164.36 -38.73 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 112.313 -2.221 . . . . 0.0 109.4 179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.814 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 84.5 m-85 -56.72 -59.92 10.91 Favored Pre-proline 0 CA--C 1.537 0.463 0 O-C-N 123.469 0.481 . . . . 0.0 110.029 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.814 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 98.0 Cg_endo -86.2 -178.34 2.77 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 122.613 2.209 . . . . 0.0 112.074 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -93.6 91.58 7.14 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.71 -16.53 79.03 Favored Glycine 0 CA--C 1.518 0.239 0 C-N-CA 121.069 -0.586 . . . . 0.0 113.097 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -79.75 79.81 1.64 Allowed Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.362 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 40.3 mm . . . . . 0 C--O 1.245 0.831 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.437 -179.77 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.421 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.484 1.876 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.635 HD22 ' HA2' ' B' ' 41' ' ' GLY . 13.1 mt -62.47 -53.73 54.99 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-O 119.247 -0.406 . . . . 0.0 111.355 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.482 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 50.6 Cg_exo -45.75 -38.1 17.02 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.556 2.171 . . . . 0.0 112.52 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -72.03 -23.12 61.33 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.898 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' C' ' 88' ' ' LEU . 84.7 t -66.65 -48.65 79.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 120.939 0.4 . . . . 0.0 109.994 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 1.04 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -72.62 -25.24 61.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.845 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 64.2 m -72.48 -21.21 61.25 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.48 ' HA ' ' HG2' ' C' ' 91' ' ' GLN . 63.4 tp -79.9 -26.3 40.27 Favored 'General case' 0 N--CA 1.438 -1.048 0 CA-C-N 114.634 -1.166 . . . . 0.0 108.626 177.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 1.04 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 0.7 OUTLIER -64.23 -48.14 76.95 Favored 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.452 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' C' ' 87' ' ' SER . 2.5 pt20 -63.5 -47.7 80.62 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.931 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.48 ' HG2' ' HA ' ' C' ' 88' ' ' LEU . 16.1 pt20 -69.21 -20.51 63.98 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 119.999 -0.68 . . . . 0.0 111.0 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 2.2 t -78.05 -34.68 19.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.749 ' HA ' HE21 ' C' ' 96' ' ' GLN . 47.4 mt-10 -69.86 -30.32 67.76 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 177.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -61.58 -59.8 4.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.088 -1.415 . . . . 0.0 110.092 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.69 -38.81 89.17 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.455 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.749 HE21 ' HA ' ' C' ' 93' ' ' GLU . 10.0 pt20 -66.64 -22.1 66.11 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.564 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.666 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -68.6 -32.95 75.38 Favored Glycine 0 C--O 1.24 0.473 0 C-N-CA 120.084 -1.055 . . . . 0.0 110.753 177.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.793 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 52.7 mt-30 -72.04 -46.97 54.99 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 178.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.711 HG11 ' HB ' ' B' ' 59' ' ' VAL . 0.2 OUTLIER -64.77 -37.55 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 C-N-CA 120.339 -0.544 . . . . 0.0 111.125 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.666 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 14.6 pt20 -62.34 -42.14 99.15 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.851 -177.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -80.48 -17.83 50.45 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 119.738 -0.785 . . . . 0.0 110.44 179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.793 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 48.4 mt -73.53 -40.49 63.96 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.557 ' HB2' HD11 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -71.1 -37.57 72.4 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.661 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.69 -55.88 28.53 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.043 178.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.728 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -61.85 -44.08 97.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.46 179.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.693 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -55.0 -25.23 28.53 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.596 -179.82 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 32.0 t -51.33 -26.23 7.25 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.09 0.471 . . . . 0.0 110.887 179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.724 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 99.2 mm-40 -100.72 -40.76 7.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.321 178.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.756 ' HA ' HG13 ' C' ' 112' ' ' VAL . 39.5 m-85 -73.1 -19.21 61.2 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' C' ' 106' ' ' PHE . 43.9 mtmt -69.53 -8.88 51.03 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.652 0.263 . . . . 0.0 110.435 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.724 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -127.85 34.41 4.63 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 120.658 -0.417 . . . . 0.0 111.599 179.595 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.756 HG13 ' HA ' ' C' ' 109' ' ' TYR . 0.8 OUTLIER -103.44 -35.03 3.6 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.399 177.759 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' B' ' 68' ' ' GLN . 31.3 tt0 -85.85 87.24 7.38 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-O 122.849 1.309 . . . . 0.0 110.454 178.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.601 HD11 ' O ' ' C' ' 111' ' ' LYS . 0.2 OUTLIER -164.82 -38.81 0.03 OUTLIER 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 112.14 -2.3 . . . . 0.0 109.313 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.828 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 83.5 m-85 -56.42 -59.63 11.52 Favored Pre-proline 0 N--CA 1.468 0.458 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.828 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 67.9 Cg_endo -86.51 -179.35 3.02 Favored 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.49 2.127 . . . . 0.0 112.042 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -92.39 92.93 8.34 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.63 -16.74 77.03 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.98 -179.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -79.39 82.25 1.39 Allowed Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.706 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 39.6 mm . . . . . 0 C--O 1.245 0.865 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.336 -179.7 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.446 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.532 ' N ' ' HD2' ' A' ' 3' ' ' PRO . 91.1 mt -56.92 -55.91 38.78 Favored Pre-proline 0 CA--C 1.532 0.279 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.532 ' HD2' ' N ' ' A' ' 2' ' ' LEU . 6.1 Cg_exo -46.31 -44.69 19.88 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 123.258 2.638 . . . . 0.0 113.1 -178.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -66.3 -41.46 89.72 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.094 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 1' ' ' GLY . 91.1 t -64.36 -41.92 93.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.643 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.58 -29.52 68.9 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.681 179.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.0 m -67.03 -23.41 65.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.394 0.616 . . . . 0.0 109.736 178.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.576 ' O ' ' HB ' ' A' ' 12' ' ' VAL . 68.0 tp -79.39 -24.66 42.45 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.449 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 12.7 mmm-85 -71.83 -33.69 68.7 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -75.19 -42.61 55.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.379 179.093 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 7' ' ' SER . 97.3 mm-40 -65.2 -32.8 74.66 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 121.401 0.619 . . . . 0.0 110.308 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -77.91 -26.94 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.172 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 70.3 tt0 -69.55 -30.62 68.47 Favored 'General case' 0 C--O 1.227 -0.091 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.14 -51.41 46.39 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.69 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 52.1 mt -58.7 -31.92 68.7 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.073 179.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.444 ' HA ' HG12 ' A' ' 19' ' ' VAL . 21.1 tt0 -70.6 -48.26 56.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.711 179.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 20' ' ' GLN . . . -59.61 -29.69 67.36 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.602 -0.809 . . . . 0.0 111.435 179.473 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.719 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -73.35 -50.51 21.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.045 0.45 . . . . 0.0 111.065 179.579 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.444 HG12 ' HA ' ' A' ' 16' ' ' GLN . 14.5 p -67.62 -31.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 -179.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 17' ' ' GLY . 16.5 pt20 -70.45 -41.53 72.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.811 -0.177 . . . . 0.0 110.869 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -78.07 -18.31 55.92 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.239 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.719 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 15.3 mt -71.19 -40.29 71.31 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.465 ' HG2' HD21 ' C' ' 102' ' ' LEU . 0.4 OUTLIER -71.14 -34.01 70.62 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -55.68 31.44 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.296 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.669 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -62.96 -39.08 93.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.479 178.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.509 ' HD1' ' HB2' ' A' ' 29' ' ' TYR . 0.0 OUTLIER -55.73 -26.49 45.71 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.516 179.459 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 41.9 t -50.2 -32.54 16.69 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.225 0.536 . . . . 0.0 110.371 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.781 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 16.2 mm100 -87.88 -53.69 4.62 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.342 177.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.669 ' HE2' ' HB1' ' A' ' 25' ' ' ALA . 14.1 m-85 -60.7 -20.59 61.46 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.454 ' HA ' ' CZ ' ' C' ' 109' ' ' TYR . 14.7 mttp -66.11 -35.35 80.26 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.497 0.189 . . . . 0.0 110.822 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -100.35 33.17 2.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.232 0.539 . . . . 0.0 110.825 179.591 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.663 ' CG2' ' HA ' ' A' ' 29' ' ' TYR . 67.5 t -97.24 -43.97 12.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.708 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' C' ' 112' ' ' VAL . 7.0 tt0 -119.74 105.48 11.19 Favored 'General case' 0 CA--C 1.5 -0.959 0 CA-C-O 122.315 1.055 . . . . 0.0 109.583 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -167.97 -33.93 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.741 -2.027 . . . . 0.0 109.007 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.765 ' CD1' ' HD3' ' A' ' 36' ' ' PRO . 7.2 p90 -79.9 -37.85 1.14 Allowed Pre-proline 0 CA--C 1.545 0.776 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.678 177.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.765 ' HD3' ' CD1' ' A' ' 35' ' ' PHE . 22.7 Cg_endo -95.87 -154.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.363 1.33 0 C-N-CA 122.376 2.051 . . . . 0.0 111.181 178.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -150.57 81.79 1.35 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.37 -128.46 27.63 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.244 -178.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -166.99 -90.09 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.697 179.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 4.8 tt . . . . . 0 C--O 1.245 0.836 0 CA-C-O 118.558 -0.734 . . . . 0.0 109.651 178.976 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.475 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 112.196 -0.362 . . . . 0.0 112.196 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.544 ' N ' ' HD2' ' B' ' 43' ' ' PRO . 89.1 mt -57.62 -55.53 43.77 Favored Pre-proline 0 N--CA 1.464 0.264 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' B' ' 42' ' ' LEU . 6.0 Cg_exo -46.77 -45.42 20.3 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.081 2.52 . . . . 0.0 113.07 -178.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -65.51 -40.44 93.0 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.91 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.475 HG23 ' O ' ' B' ' 41' ' ' GLY . 85.6 t -65.21 -42.15 93.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.666 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.87 -29.15 68.19 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.811 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.678 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 53.7 m -67.29 -23.33 65.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.42 0.628 . . . . 0.0 109.847 178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.569 ' O ' ' HB ' ' B' ' 52' ' ' VAL . 66.8 tp -79.57 -24.6 41.99 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.295 179.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.666 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 13.2 mmm-85 -71.62 -33.44 68.97 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.678 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -75.8 -41.81 51.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.425 179.221 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 47' ' ' SER . 97.2 mm-40 -65.57 -33.42 75.88 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 121.563 0.697 . . . . 0.0 110.083 178.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.569 ' HB ' ' O ' ' B' ' 48' ' ' LEU . 0.3 OUTLIER -76.99 -27.07 16.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.261 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -69.58 -31.35 69.46 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -67.6 -50.72 56.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.077 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' B' ' 51' ' ' GLN . 52.6 mt -59.04 -32.47 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.967 179.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.43 ' HA ' HG12 ' B' ' 59' ' ' VAL . 22.6 tt0 -70.26 -48.0 58.78 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.715 179.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' B' ' 60' ' ' GLN . . . -59.97 -29.13 67.29 Favored Glycine 0 CA--C 1.52 0.366 0 C-N-CA 120.515 -0.85 . . . . 0.0 111.653 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.75 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -74.03 -50.05 21.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.936 0.398 . . . . 0.0 110.96 179.453 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.43 HG12 ' HA ' ' B' ' 56' ' ' GLN . 14.8 p -67.84 -31.8 53.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 O-C-N 122.131 -0.356 . . . . 0.0 111.902 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' B' ' 57' ' ' GLY . 16.6 pt20 -70.23 -41.74 73.2 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.779 -0.192 . . . . 0.0 110.836 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -78.17 -18.38 55.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 119.762 -0.775 . . . . 0.0 110.463 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.75 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 16.5 mt -71.41 -39.16 71.29 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.455 ' HG2' HD21 ' A' ' 22' ' ' LEU . 0.5 OUTLIER -71.85 -33.72 68.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 178.448 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.51 -55.19 38.03 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.3 178.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.654 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -63.41 -39.21 93.88 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.354 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.521 ' HD2' HD22 ' A' ' 22' ' ' LEU . 0.0 OUTLIER -55.95 -26.13 46.6 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.457 179.329 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 42.7 t -50.74 -31.78 17.7 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 121.201 0.524 . . . . 0.0 110.226 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.754 ' HA ' ' HE3' ' B' ' 71' ' ' LYS . 15.9 mm100 -88.09 -53.51 4.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.413 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.654 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 13.2 m-85 -60.97 -20.95 63.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 29' ' ' TYR . 14.7 mttp -65.66 -36.08 82.64 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 121.041 -0.264 . . . . 0.0 110.877 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.754 ' HE3' ' HA ' ' B' ' 68' ' ' GLN . 0.0 OUTLIER -99.6 33.11 2.59 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.481 0.658 . . . . 0.0 110.989 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.648 ' CG2' ' HA ' ' B' ' 69' ' ' TYR . 62.5 t -96.82 -43.55 12.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.789 178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -120.29 105.61 11.09 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 122.301 1.048 . . . . 0.0 109.733 176.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.705 HD23 ' H ' ' B' ' 75' ' ' PHE . 0.2 OUTLIER -168.65 -34.56 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 112.771 -2.013 . . . . 0.0 108.686 -178.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.771 ' CD1' ' HD3' ' B' ' 76' ' ' PRO . 6.5 p90 -78.87 -38.95 1.45 Allowed Pre-proline 0 CA--C 1.544 0.737 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.508 177.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.771 ' HD3' ' CD1' ' B' ' 75' ' ' PHE . 23.7 Cg_endo -96.22 -159.9 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.018 0 C-N-CA 122.594 2.196 . . . . 0.0 111.191 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -145.98 83.65 1.64 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.49 -131.27 32.13 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.579 -0.82 . . . . 0.0 111.261 -178.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -163.92 -89.34 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.77 -0.729 . . . . 0.0 111.884 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 5.6 tt . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.451 -0.785 . . . . 0.0 110.13 179.432 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.442 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 112.246 -0.341 . . . . 0.0 112.246 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.535 ' N ' ' HD2' ' C' ' 83' ' ' PRO . 89.2 mt -55.18 -55.74 36.09 Favored Pre-proline 0 N--CA 1.466 0.352 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.535 ' HD2' ' N ' ' C' ' 82' ' ' LEU . 6.0 Cg_exo -46.67 -45.28 20.22 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.055 2.503 . . . . 0.0 112.986 -178.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -65.66 -41.89 91.99 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.061 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.442 HG23 ' O ' ' C' ' 81' ' ' GLY . 88.0 t -63.82 -42.26 95.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.77 -29.42 68.62 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.924 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.691 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 54.4 m -67.05 -23.78 65.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.471 0.653 . . . . 0.0 109.524 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.631 ' O ' HG22 ' C' ' 92' ' ' VAL . 66.9 tp -78.15 -25.6 47.38 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.78 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.599 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 10.2 mmm-85 -72.5 -31.14 65.11 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -76.26 -40.81 50.9 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.474 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' C' ' 87' ' ' SER . 97.4 mm-40 -65.82 -34.45 78.18 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 178.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.631 HG22 ' O ' ' C' ' 88' ' ' LEU . 1.1 m -74.59 -28.99 22.78 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.692 0 C-N-CA 120.125 -0.63 . . . . 0.0 110.468 178.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -65.94 -32.44 73.93 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -67.53 -52.53 37.84 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 114.709 -1.132 . . . . 0.0 109.912 178.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.409 HD21 ' HB2' ' A' ' 16' ' ' GLN . 0.3 OUTLIER -56.75 -34.44 67.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.119 178.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.443 ' HA ' HG12 ' C' ' 99' ' ' VAL . 22.0 tt0 -69.68 -48.07 60.99 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.655 179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.444 ' O ' ' HG2' ' C' ' 100' ' ' GLN . . . -59.39 -29.62 66.6 Favored Glycine 0 C--O 1.237 0.291 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.545 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.739 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -74.17 -50.44 19.29 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.406 -0.397 . . . . 0.0 111.047 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.443 HG12 ' HA ' ' C' ' 96' ' ' GLN . 14.9 p -67.5 -31.88 54.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' C' ' 97' ' ' GLY . 17.0 pt20 -70.02 -42.3 73.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.942 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -77.58 -18.1 57.21 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 119.589 -0.845 . . . . 0.0 110.253 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 15.6 mt -71.26 -39.57 71.51 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.586 ' HG2' HD21 ' B' ' 62' ' ' LEU . 0.7 OUTLIER -71.1 -34.99 71.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.876 -1.056 . . . . 0.0 108.27 178.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.89 -56.07 26.36 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.425 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.658 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.7 -38.28 89.82 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.584 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.514 ' HD2' HD22 ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.89 -26.12 58.26 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.439 179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 42.1 t -50.37 -32.66 18.01 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.095 0.474 . . . . 0.0 109.951 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.773 ' HA ' ' HE3' ' C' ' 111' ' ' LYS . 15.9 mm100 -87.68 -53.02 5.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.645 177.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.665 ' HA ' ' CG2' ' C' ' 112' ' ' VAL . 13.2 m-85 -61.6 -20.54 63.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 69' ' ' TYR . 14.5 mttp -65.91 -36.06 82.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.635 0.255 . . . . 0.0 110.686 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.773 ' HE3' ' HA ' ' C' ' 108' ' ' GLN . 0.0 OUTLIER -99.3 33.03 2.54 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.157 0.503 . . . . 0.0 111.055 179.241 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.665 ' CG2' ' HA ' ' C' ' 109' ' ' TYR . 60.0 t -96.94 -43.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.852 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.401 ' HB2' ' CG2' ' B' ' 72' ' ' VAL . 6.4 tt0 -120.47 105.66 11.08 Favored 'General case' 0 CA--C 1.501 -0.913 0 CA-C-O 122.45 1.119 . . . . 0.0 109.741 176.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.694 HD23 ' H ' ' C' ' 115' ' ' PHE . 0.2 OUTLIER -168.35 -34.27 0.02 OUTLIER 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 112.783 -2.008 . . . . 0.0 108.84 -178.925 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.783 ' CD1' ' HD3' ' C' ' 116' ' ' PRO . 6.4 p90 -78.82 -39.21 1.5 Allowed Pre-proline 0 CA--C 1.542 0.662 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.603 177.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.783 ' HD3' ' CD1' ' C' ' 115' ' ' PHE . 21.1 Cg_endo -95.56 -159.0 0.05 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 122.403 2.069 . . . . 0.0 111.334 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -146.57 84.22 1.62 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . 65.24 -129.99 34.88 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.425 -178.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.21 -91.37 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.956 -0.64 . . . . 0.0 111.733 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt . . . . . 0 C--O 1.245 0.839 0 CA-C-O 118.514 -0.755 . . . . 0.0 110.342 179.288 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.485 1.915 0 N-CA-C 111.523 -0.631 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 3' ' ' PRO . 3.2 tm? -60.7 -53.42 64.5 Favored Pre-proline 0 CA--C 1.534 0.328 0 CA-C-O 119.366 -0.349 . . . . 0.0 110.751 179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 2' ' ' LEU . 78.4 Cg_exo -42.32 -44.72 7.91 Favored 'Trans proline' 0 C--N 1.363 1.314 0 C-N-CA 123.135 2.556 . . . . 0.0 113.197 -179.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.21 -43.92 97.75 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.638 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 1' ' ' GLY . 46.6 t -61.58 -47.3 93.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.062 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.738 ' HA ' ' HG2' ' A' ' 9' ' ' ARG . . . -67.12 -24.17 65.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.282 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.673 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 68.2 m -68.04 -29.01 67.89 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-O 121.721 0.772 . . . . 0.0 109.125 178.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 51.1 tp -75.75 -22.4 56.54 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.152 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.738 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 41.3 mmm-85 -65.77 -37.58 86.72 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 178.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 7' ' ' SER . 0.0 OUTLIER -67.03 -43.79 81.9 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.656 179.551 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 36.9 tt0 -63.6 -31.3 72.42 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.89 0.852 . . . . 0.0 109.61 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.55 -28.91 29.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.769 179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.818 ' HA ' HE21 ' A' ' 16' ' ' GLN . 58.0 mt-10 -68.15 -29.47 68.36 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -68.01 -55.4 12.76 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 114.627 -1.169 . . . . 0.0 110.314 177.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.439 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.9 mm? -59.8 -36.84 77.57 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.734 -1.121 . . . . 0.0 111.827 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.818 HE21 ' HA ' ' A' ' 13' ' ' GLU . 24.7 pt20 -75.13 -26.83 59.48 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.181 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.616 ' HA2' HE21 ' A' ' 20' ' ' GLN . . . -68.63 -33.49 76.4 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 177.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.729 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 93.1 mm-40 -70.76 -48.62 53.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.438 -0.381 . . . . 0.0 110.837 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 16' ' ' GLN . 6.1 p -67.43 -33.96 65.68 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.616 HE21 ' HA2' ' A' ' 17' ' ' GLY . 15.9 pt20 -66.6 -45.7 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.941 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.498 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 6.9 p-80 -74.57 -17.52 60.71 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 119.736 -0.786 . . . . 0.0 110.433 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 18' ' ' GLN . 13.8 mt -72.05 -37.8 69.6 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.706 ' HG2' HD21 ' C' ' 102' ' ' LEU . 74.1 mt-30 -70.88 -30.38 66.73 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 21' ' ' HIS . . . -57.43 -59.19 5.52 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 114.775 -1.102 . . . . 0.0 109.465 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.503 ' HB1' ' HE2' ' A' ' 29' ' ' TYR . . . -61.43 -39.68 91.69 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.32 -0.854 . . . . 0.0 110.117 178.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' A' ' 22' ' ' LEU . 0.0 OUTLIER -56.27 -26.61 52.41 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.007 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.8 t -59.22 -28.18 66.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.989 0.423 . . . . 0.0 110.822 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.644 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 14.5 mm100 -89.59 -33.87 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.561 ' CE1' ' HB3' ' B' ' 73' ' ' GLU . 21.6 m-85 -78.45 -18.4 54.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.581 -179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.491 ' HA ' ' OH ' ' C' ' 109' ' ' TYR . 8.5 tmtt? -55.47 -46.73 76.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.303 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.756 ' HD3' ' H ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -91.13 37.29 0.93 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.408 0.623 . . . . 0.0 111.219 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.691 HG11 HG12 ' B' ' 72' ' ' VAL . 96.2 t -121.19 3.85 6.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.97 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.56 ' HB3' ' CE1' ' C' ' 109' ' ' TYR . 9.5 pt-20 -93.85 -27.63 16.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 O-C-N 121.681 -0.637 . . . . 0.0 112.288 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.633 HD13 ' H ' ' A' ' 34' ' ' LEU . 0.0 OUTLIER -54.99 -27.27 42.85 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.479 0.657 . . . . 0.0 110.499 179.422 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.956 ' HB3' ' HD2' ' A' ' 36' ' ' PRO . 43.2 m-85 -55.61 179.33 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.885 0 CA-C-N 114.008 -1.451 . . . . 0.0 111.404 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.956 ' HD2' ' HB3' ' A' ' 35' ' ' PHE . 38.6 Cg_endo -67.47 174.61 7.07 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.627 2.218 . . . . 0.0 113.634 -179.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -104.58 143.65 32.76 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.897 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.503 ' HA3' ' CD1' ' C' ' 114' ' ' LEU . . . -95.1 -65.99 0.99 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.461 -0.876 . . . . 0.0 111.566 179.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.467 ' H ' ' HB2' ' C' ' 111' ' ' LYS . . . -93.28 -76.93 1.35 Allowed Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.243 0.725 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.424 178.346 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.431 ' O ' HG23 ' B' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.486 1.987 0 N-CA-C 111.874 -0.49 . . . . 0.0 111.874 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.529 ' HB3' ' HD3' ' B' ' 43' ' ' PRO . 3.2 tm? -60.32 -53.35 65.66 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.491 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 42' ' ' LEU . 64.4 Cg_exo -42.37 -44.72 8.02 Favored 'Trans proline' 0 C--N 1.363 1.329 0 C-N-CA 123.161 2.574 . . . . 0.0 113.323 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.54 -43.34 99.06 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.484 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.431 HG23 ' O ' ' B' ' 41' ' ' GLY . 46.0 t -61.92 -47.25 94.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.875 179.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.754 ' HA ' ' HG2' ' B' ' 49' ' ' ARG . . . -67.34 -23.65 65.64 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.157 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.648 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 68.1 m -68.38 -28.41 67.08 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.856 0.836 . . . . 0.0 109.35 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 54.3 tp -76.61 -22.54 54.04 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.885 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.754 ' HG2' ' HA ' ' B' ' 46' ' ' ALA . 41.7 mmm-85 -65.25 -38.59 90.8 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' B' ' 47' ' ' SER . 0.0 OUTLIER -66.58 -43.8 83.95 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.048 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.455 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 38.6 tt0 -62.96 -31.87 73.07 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.983 0.897 . . . . 0.0 109.377 178.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -72.21 -29.58 32.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.841 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . 0.763 ' HA ' HE21 ' B' ' 56' ' ' GLN . 54.9 mt-10 -67.45 -28.37 67.82 Favored 'General case' 0 C--O 1.232 0.152 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.455 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -69.01 -55.69 10.07 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.18 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.462 ' HA ' HD13 ' B' ' 55' ' ' LEU . 3.0 mm? -59.27 -37.46 77.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.739 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.763 HE21 ' HA ' ' B' ' 53' ' ' GLU . 24.3 pt20 -74.43 -27.36 60.58 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.637 -0.425 . . . . 0.0 110.487 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.619 ' HA2' HE21 ' B' ' 60' ' ' GLN . . . -68.7 -32.78 74.74 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.441 -1.064 . . . . 0.0 110.441 177.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.748 ' O ' ' HG ' ' B' ' 62' ' ' LEU . 94.4 mm-40 -70.65 -49.2 49.89 Favored 'General case' 0 C--O 1.221 -0.439 0 CA-C-O 121.017 0.437 . . . . 0.0 111.011 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.568 HG12 ' HA ' ' B' ' 56' ' ' GLN . 5.7 p -67.2 -33.95 66.24 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -178.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.619 HE21 ' HA2' ' B' ' 57' ' ' GLY . 15.7 pt20 -66.41 -45.6 79.38 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.119 178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.505 ' O ' ' HB3' ' B' ' 64' ' ' ALA . 7.3 p-80 -74.62 -17.76 60.65 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.451 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.748 ' HG ' ' O ' ' B' ' 58' ' ' GLN . 14.8 mt -71.93 -38.46 69.85 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.695 ' HG2' HD21 ' A' ' 22' ' ' LEU . 73.7 mt-30 -70.23 -30.95 68.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.505 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.21 -58.13 9.58 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.722 178.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.526 ' HB1' ' HE2' ' B' ' 69' ' ' TYR . . . -62.05 -40.0 94.28 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.082 178.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.443 ' HB2' ' O ' ' B' ' 62' ' ' LEU . 0.0 OUTLIER -56.55 -25.9 53.38 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.107 -0.951 . . . . 0.0 112.083 -179.849 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -59.71 -28.92 67.74 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.639 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . 0.686 ' HA ' ' HE2' ' B' ' 71' ' ' LYS . 14.5 mm100 -89.07 -33.35 17.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.753 0.311 . . . . 0.0 111.007 179.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.526 ' HE2' ' HB1' ' B' ' 65' ' ' ALA . 21.8 m-85 -78.84 -17.48 55.58 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.694 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.502 ' HA ' ' OH ' ' A' ' 29' ' ' TYR . 8.7 tmtt? -56.31 -47.32 78.94 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.377 -179.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.739 ' HD3' ' H ' ' B' ' 71' ' ' LYS . 0.5 OUTLIER -90.09 37.23 0.88 Allowed 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.141 -0.624 . . . . 0.0 111.184 179.688 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.691 HG12 HG11 ' A' ' 32' ' ' VAL . 99.4 t -120.84 2.63 6.73 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.074 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.561 ' HB3' ' CE1' ' A' ' 29' ' ' TYR . 9.5 pt-20 -93.02 -26.76 17.37 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.599 -0.688 . . . . 0.0 112.194 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.649 ' H ' HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER -55.36 -26.54 41.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.363 0.601 . . . . 0.0 110.295 179.678 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.945 ' HB3' ' HD2' ' B' ' 76' ' ' PRO . 42.0 m-85 -56.23 178.67 0.13 Allowed Pre-proline 0 CA--C 1.546 0.799 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.482 178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.945 ' HD2' ' HB3' ' B' ' 75' ' ' PHE . 37.9 Cg_endo -66.92 175.56 5.37 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.464 2.109 . . . . 0.0 113.391 -179.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -105.17 143.13 33.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.691 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . 0.427 ' HA3' ' HG ' ' A' ' 34' ' ' LEU . . . -94.81 -63.08 1.01 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.638 179.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.463 ' H ' ' HB2' ' A' ' 31' ' ' LYS . . . -96.49 -75.59 1.26 Allowed Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 178.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.245 0.86 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.298 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.4 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.2 -0.36 . . . . 0.0 112.2 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.535 ' HB3' ' HD3' ' C' ' 83' ' ' PRO . 3.3 tm? -59.68 -53.11 68.87 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-O 119.263 -0.399 . . . . 0.0 110.733 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.535 ' HD3' ' HB3' ' C' ' 82' ' ' LEU . 69.4 Cg_exo -42.68 -44.16 8.71 Favored 'Trans proline' 0 C--N 1.363 1.298 0 C-N-CA 123.1 2.533 . . . . 0.0 113.36 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -63.05 -43.33 98.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.671 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.4 HG23 ' O ' ' C' ' 81' ' ' GLY . 47.0 t -62.01 -46.29 96.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.855 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.704 ' HA ' ' HG2' ' C' ' 89' ' ' ARG . . . -67.59 -25.97 66.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.196 179.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.638 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 66.7 m -66.64 -28.56 68.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 121.745 0.783 . . . . 0.0 109.237 178.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.676 ' O ' HG13 ' C' ' 92' ' ' VAL . 46.5 tp -75.76 -25.07 56.16 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.116 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.704 ' HG2' ' HA ' ' C' ' 86' ' ' ALA . 34.8 mmm-85 -65.43 -35.88 82.25 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 177.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.638 ' HG3' ' O ' ' C' ' 87' ' ' SER . 0.0 OUTLIER -67.34 -43.26 82.0 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.364 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -63.6 -32.43 73.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.75 178.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.676 HG13 ' O ' ' C' ' 88' ' ' LEU . 6.0 m -74.91 -23.05 17.31 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.385 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.879 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.801 ' HA ' HE21 ' C' ' 96' ' ' GLN . 55.8 mt-10 -67.96 -29.81 68.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 177.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . . . . . . . . . . . -69.46 -55.1 11.24 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.135 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.433 ' HA ' HD13 ' C' ' 95' ' ' LEU . 3.4 mm? -59.1 -37.92 78.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.685 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.801 HE21 ' HA ' ' C' ' 93' ' ' GLU . 24.1 pt20 -73.78 -28.03 61.45 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.412 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.751 ' HA2' HE21 ' C' ' 100' ' ' GLN . . . -67.09 -33.07 82.28 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.736 ' O ' ' HG ' ' C' ' 102' ' ' LEU . 92.6 mm-40 -70.15 -47.26 62.44 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 115.159 -0.52 . . . . 0.0 110.422 178.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.62 HG23 ' HA ' ' C' ' 96' ' ' GLN . 0.0 OUTLIER -63.38 -43.78 98.68 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 C-N-CA 120.101 -0.64 . . . . 0.0 111.735 -179.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.751 HE21 ' HA2' ' C' ' 97' ' ' GLY . 17.4 pt20 -59.7 -44.84 93.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.455 -177.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.529 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 7.2 p-80 -76.83 -18.82 58.15 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.504 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.736 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 13.2 mt -70.93 -38.24 72.89 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.704 ' HG2' HD21 ' B' ' 62' ' ' LEU . 72.9 mt-30 -72.08 -30.07 64.75 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.96 -57.7 11.64 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.468 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.532 ' HB1' ' HE2' ' C' ' 109' ' ' TYR . . . -62.62 -40.3 96.54 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.828 178.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.434 ' HB2' ' O ' ' C' ' 102' ' ' LEU . 0.0 OUTLIER -56.15 -25.82 47.87 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.346 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 13.1 t -60.28 -27.83 67.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.99 0.424 . . . . 0.0 110.72 -179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . 0.678 ' HA ' ' HE2' ' C' ' 111' ' ' LYS . 14.6 mm100 -89.75 -32.69 16.87 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.828 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.56 ' CE1' ' HB3' ' A' ' 33' ' ' GLU . 22.1 m-85 -79.17 -18.29 53.36 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.664 -179.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.495 ' HA ' ' OH ' ' B' ' 69' ' ' TYR . 9.0 tmtt? -55.46 -47.33 76.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.62 -179.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.788 ' HD3' ' H ' ' C' ' 111' ' ' LYS . 0.4 OUTLIER -90.12 38.08 0.92 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.419 0.628 . . . . 0.0 111.111 179.626 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.686 HG12 HG11 ' B' ' 72' ' ' VAL . 92.7 t -122.15 2.66 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.339 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.525 ' HB3' ' CE1' ' B' ' 69' ' ' TYR . 9.8 pt-20 -92.04 -29.55 16.52 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.355 -0.841 . . . . 0.0 112.452 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.544 ' H ' ' HG ' ' C' ' 114' ' ' LEU . 0.1 OUTLIER -53.88 -24.3 15.52 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 124.033 0.933 . . . . 0.0 110.539 178.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 1.019 ' HB3' ' HD2' ' C' ' 116' ' ' PRO . 43.2 m-85 -61.07 -178.87 0.19 Allowed Pre-proline 0 CA--C 1.543 0.68 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.618 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 1.019 ' HD2' ' HB3' ' C' ' 115' ' ' PHE . 37.6 Cg_endo -67.17 176.76 4.31 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.361 2.04 . . . . 0.0 113.269 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -106.23 143.14 34.78 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.825 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . . . . . . . . . . . -93.75 -66.51 1.05 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.603 -0.808 . . . . 0.0 111.249 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . 0.439 ' H ' ' HB2' ' B' ' 71' ' ' LYS . . . -94.27 -73.91 1.23 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.537 -0.84 . . . . 0.0 111.074 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 mp . . . . . 0 C--O 1.242 0.698 0 CA-C-O 118.592 -0.718 . . . . 0.0 109.319 178.668 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.43 ' O ' HG23 ' A' ' 5' ' ' VAL . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.185 -0.366 . . . . 0.0 112.185 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.2 mp -57.73 -54.74 52.15 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 119.109 -0.472 . . . . 0.0 111.804 179.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -44.36 -42.02 13.65 Favored 'Trans proline' 0 C--N 1.362 1.269 0 C-N-CA 122.726 2.284 . . . . 0.0 112.884 -179.335 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 83.7 m-20 -64.59 -37.28 87.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.074 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.722 HG22 HG11 ' B' ' 45' ' ' VAL . 44.4 t -66.05 -41.04 88.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.267 179.452 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 9' ' ' ARG . . . -69.53 -34.95 74.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.312 0.577 . . . . 0.0 109.681 178.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 10' ' ' GLN . 50.9 m -71.9 -19.54 61.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.987 0.898 . . . . 0.0 108.695 177.398 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.556 ' O ' HG23 ' A' ' 12' ' ' VAL . 36.6 tp -72.62 -28.05 62.52 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.442 179.663 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 6' ' ' ALA . 29.8 mmm-85 -62.42 -22.71 66.39 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.975 179.075 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 7' ' ' SER . 1.2 mt-30 -74.28 -35.66 63.76 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.84 -179.712 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 99.0 mm-40 -71.53 -25.53 62.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.171 178.16 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.558 HG13 HD11 ' C' ' 95' ' ' LEU . 60.1 t -75.42 -40.26 42.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.367 178.684 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tp10 -62.17 -33.55 74.74 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 11' ' ' GLN . . . -65.73 -55.17 18.76 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 113.974 -1.466 . . . . 0.0 110.772 178.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.584 HD11 HG13 ' B' ' 52' ' ' VAL . 78.8 mt -55.11 -45.18 75.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.719 -179.334 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.476 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 23.4 pt20 -72.66 -25.2 61.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.134 -179.553 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.474 ' HA2' ' HG2' ' A' ' 20' ' ' GLN . . . -67.75 -31.78 76.63 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 109.955 -1.258 . . . . 0.0 109.955 177.552 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.669 ' HB3' HG11 ' B' ' 59' ' ' VAL . 14.1 mm100 -71.51 -40.34 70.21 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.068 -0.566 . . . . 0.0 110.112 178.392 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' C' ' 98' ' ' GLN . 2.9 t -67.12 -44.98 87.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.523 -179.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 16' ' ' GLN . 8.7 pt20 -61.47 -43.09 99.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.678 -178.548 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.497 ' CE1' ' HA ' ' A' ' 18' ' ' GLN . 6.1 p-80 -77.75 -17.63 57.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.175 -179.667 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.671 HD11 ' HG2' ' B' ' 63' ' ' GLN . 1.2 mp -77.12 -35.54 56.2 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 120.099 -0.641 . . . . 0.0 109.56 178.518 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.443 ' HG2' HD21 ' C' ' 102' ' ' LEU . 66.2 mt-30 -74.97 -30.63 61.25 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.29 -53.9 53.04 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.415 -1.266 . . . . 0.0 108.229 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.68 -46.71 86.65 Favored 'General case' 0 N--CA 1.444 -0.761 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.508 178.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.407 ' HB2' ' HA ' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -47.88 -33.1 7.04 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 123.86 0.725 . . . . 0.0 112.502 179.558 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.3 t -53.96 -34.01 58.53 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.853 0.358 . . . . 0.0 111.582 -179.301 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -86.05 -12.77 49.32 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.865 0.364 . . . . 0.0 111.522 179.534 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.768 ' O ' HG22 ' A' ' 32' ' ' VAL . 62.4 m-85 -103.74 -16.03 15.56 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.348 0.594 . . . . 0.0 109.509 179.347 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.605 ' HA ' ' HE2' ' C' ' 109' ' ' TYR . 82.5 mttt -63.49 -17.74 63.07 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.443 179.613 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.597 ' HA ' HD11 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -102.25 22.82 12.65 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.184 -1.006 . . . . 0.0 111.563 179.03 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.768 HG22 ' O ' ' A' ' 29' ' ' TYR . 4.3 m -119.06 -14.72 8.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 O-C-N 121.838 -0.539 . . . . 0.0 111.964 179.745 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.482 ' HG3' ' N ' ' A' ' 34' ' ' LEU . 10.7 pt-20 -75.43 -28.63 59.44 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.597 HD11 ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -91.53 -41.61 10.71 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -175.093 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' A' ' 36' ' ' PRO . 4.6 m-30 -45.85 -63.77 1.15 Allowed Pre-proline 0 N--CA 1.477 0.911 0 O-C-N 123.806 0.691 . . . . 0.0 111.35 -179.018 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' A' ' 35' ' ' PHE . 96.2 Cg_endo -81.34 171.93 13.19 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.458 2.106 . . . . 0.0 111.369 178.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.0 t30 -117.34 -89.41 0.58 Allowed 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.76 179.443 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.705 ' HA3' ' HZ ' ' C' ' 115' ' ' PHE . . . 69.22 61.8 4.32 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.849 -0.691 . . . . 0.0 111.702 -179.843 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 87.12 -98.24 2.35 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.211 -178.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 34.7 pt . . . . . 0 C--O 1.245 0.849 0 CA-C-O 118.506 -0.759 . . . . 0.0 110.461 179.227 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.415 ' HA2' HD22 ' C' ' 82' ' ' LEU . . . . . . . . 0 N--CA 1.486 1.968 0 N-CA-C 112.606 -0.197 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mp -55.73 -55.01 45.35 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-O 119.279 -0.391 . . . . 0.0 112.046 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -44.26 -43.23 13.37 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.87 2.38 . . . . 0.0 112.571 -179.308 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -63.52 -37.68 88.25 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.88 179.809 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.722 HG11 HG22 ' A' ' 5' ' ' VAL . 45.0 t -66.12 -40.7 87.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.212 179.444 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' B' ' 49' ' ' ARG . . . -69.77 -35.73 75.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.283 0.563 . . . . 0.0 109.486 178.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 47' ' ' SER . . . . . 0.687 ' O ' ' HG3' ' B' ' 50' ' ' GLN . 32.8 m -69.99 -19.95 63.31 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 122.089 0.947 . . . . 0.0 108.63 177.159 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . 0.515 ' O ' HG23 ' B' ' 52' ' ' VAL . 33.4 tp -72.29 -28.92 63.4 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.867 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 49' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' B' ' 46' ' ' ALA . 31.5 mmm-85 -61.26 -24.14 66.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.949 179.014 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 50' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' B' ' 47' ' ' SER . 1.1 mt-30 -72.67 -36.74 67.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.984 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' B' ' 54' ' ' ALA . 98.9 mm-40 -70.45 -26.13 63.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.496 178.108 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.584 HG13 HD11 ' A' ' 15' ' ' LEU . 57.7 t -74.73 -40.72 47.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.357 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.88 -33.75 74.77 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 178.573 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 54' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 51' ' ' GLN . . . -65.21 -55.04 20.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.916 178.273 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.534 ' O ' HG23 ' B' ' 59' ' ' VAL . 77.8 mt -55.53 -44.98 77.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.653 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 56' ' ' GLN . . . . . 0.487 ' O ' ' HG2' ' B' ' 60' ' ' GLN . 24.1 pt20 -72.83 -24.94 60.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.87 -179.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 57' ' ' GLY . . . . . 0.502 ' HA2' ' HG2' ' B' ' 60' ' ' GLN . . . -68.19 -30.9 73.95 Favored Glycine 0 C--O 1.237 0.302 0 N-CA-C 109.978 -1.249 . . . . 0.0 109.978 177.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.705 ' HB3' HG21 ' C' ' 99' ' ' VAL . 14.1 mm100 -72.02 -41.75 67.17 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.168 -0.516 . . . . 0.0 109.933 178.433 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.669 HG11 ' HB3' ' A' ' 18' ' ' GLN . 2.9 t -65.42 -46.21 90.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.402 179.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.502 ' HG2' ' HA2' ' B' ' 57' ' ' GLY . 8.9 pt20 -60.58 -43.01 97.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.762 -178.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 61' ' ' HIS . . . . . 0.489 ' CE1' ' HA ' ' B' ' 58' ' ' GLN . 6.1 p-80 -78.28 -16.82 57.4 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.249 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . 0.657 ' HG ' ' HE2' ' C' ' 106' ' ' PHE . 1.2 mp -77.56 -36.29 52.32 Favored 'General case' 0 N--CA 1.441 -0.92 0 C-N-CA 120.1 -0.64 . . . . 0.0 109.402 178.453 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.671 ' HG2' HD11 ' A' ' 22' ' ' LEU . 66.2 mt-30 -73.79 -31.49 63.3 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 176.718 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 64' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' B' ' 61' ' ' HIS . . . -57.1 -54.4 47.17 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 114.474 -1.239 . . . . 0.0 108.689 177.111 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 65' ' ' ALA . . . . . 0.408 ' O ' ' CD1' ' B' ' 69' ' ' TYR . . . -58.27 -47.12 84.61 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.3 178.413 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 66' ' ' PHE . . . . . 0.641 ' HE2' ' HG ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -47.58 -33.09 6.12 Favored 'General case' 0 C--O 1.215 -0.747 0 O-C-N 123.838 0.711 . . . . 0.0 112.682 179.36 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -54.58 -33.85 60.96 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.995 0.426 . . . . 0.0 111.524 -179.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -86.03 -12.22 50.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.912 0.387 . . . . 0.0 111.472 179.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 69' ' ' TYR . . . . . 0.789 ' O ' HG22 ' B' ' 72' ' ' VAL . 61.9 m-85 -104.05 -16.67 15.22 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 121.494 0.664 . . . . 0.0 109.327 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 29' ' ' TYR . 83.5 mttt -62.85 -17.97 62.23 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.407 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.607 ' HA ' HD11 ' B' ' 74' ' ' LEU . 0.2 OUTLIER -101.85 22.53 12.8 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.594 178.716 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.789 HG22 ' O ' ' B' ' 69' ' ' TYR . 4.2 m -118.89 -14.4 9.22 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.287 0 O-C-N 121.871 -0.518 . . . . 0.0 112.028 179.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.475 ' HG3' ' HG ' ' B' ' 74' ' ' LEU . 11.5 pt-20 -75.53 -28.55 59.14 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.702 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -91.88 -41.62 10.51 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.882 1.068 . . . . 0.0 113.882 -175.09 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 75' ' ' PHE . . . . . 0.733 ' HB2' ' HD3' ' B' ' 76' ' ' PRO . 4.5 m-30 -46.32 -62.73 1.67 Allowed Pre-proline 0 N--CA 1.479 1.015 0 O-C-N 123.533 0.521 . . . . 0.0 111.137 -179.109 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 76' ' ' PRO . . . . . 0.733 ' HD3' ' HB2' ' B' ' 75' ' ' PHE . 95.2 Cg_endo -81.43 172.46 12.55 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.445 2.097 . . . . 0.0 111.612 178.671 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.57 -89.48 0.59 Allowed 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.684 179.464 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . 0.716 ' HA3' ' HZ ' ' A' ' 35' ' ' PHE . . . 68.83 60.16 5.5 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.002 -179.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.55 -98.69 2.47 Favored Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 -178.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 35.0 pt . . . . . 0 C--O 1.247 0.938 0 CA-C-O 118.538 -0.744 . . . . 0.0 110.863 179.087 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' C' C ' 81' ' ' GLY . . . . . 0.403 ' O ' HG23 ' C' ' 85' ' ' VAL . . . . . . . . 0 N--CA 1.483 1.821 0 N-CA-C 112.024 -0.43 . . . . 0.0 112.024 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 82' ' ' LEU . . . . . 0.58 ' HB2' ' HD3' ' C' ' 83' ' ' PRO . 13.1 mt -56.58 -55.01 47.49 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-O 119.326 -0.368 . . . . 0.0 111.714 -179.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 83' ' ' PRO . . . . . 0.58 ' HD3' ' HB2' ' C' ' 82' ' ' LEU . 71.1 Cg_exo -43.31 -42.87 10.44 Favored 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 123.129 2.553 . . . . 0.0 112.657 -179.507 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 84' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -64.82 -36.69 85.14 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.1 179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 85' ' ' VAL . . . . . 0.681 HG22 HG11 ' A' ' 5' ' ' VAL . 47.2 t -66.86 -41.37 87.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.962 179.66 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 86' ' ' ALA . . . . . 0.469 ' O ' ' HG2' ' C' ' 89' ' ' ARG . . . -68.86 -35.93 77.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.393 0.616 . . . . 0.0 109.678 178.831 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 87' ' ' SER . . . . . 0.698 ' O ' ' HG3' ' C' ' 90' ' ' GLN . 44.5 m -70.9 -19.9 62.55 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.057 0.932 . . . . 0.0 108.966 177.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 88' ' ' LEU . . . . . 0.54 ' HB3' ' O ' ' C' ' 85' ' ' VAL . 35.9 tp -71.83 -28.56 63.65 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.538 179.368 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 89' ' ' ARG . . . . . 0.766 ' HA ' HG13 ' C' ' 92' ' ' VAL . 26.2 mmm-85 -63.09 -22.82 67.12 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.041 179.124 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 90' ' ' GLN . . . . . 0.698 ' HG3' ' O ' ' C' ' 87' ' ' SER . 1.0 OUTLIER -73.77 -35.25 64.96 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.886 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 91' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' C' ' 94' ' ' ALA . 99.0 mm-40 -70.98 -28.7 64.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.976 177.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 92' ' ' VAL . . . . . 0.766 HG13 ' HA ' ' C' ' 89' ' ' ARG . 0.5 OUTLIER -79.08 -31.49 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 119.982 -0.687 . . . . 0.0 110.359 179.078 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 93' ' ' GLU . . . . . 0.466 ' HA ' HE21 ' C' ' 96' ' ' GLN . 46.5 tp10 -63.37 -34.74 78.37 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 175.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 94' ' ' ALA . . . . . 0.417 ' HB3' ' O ' ' C' ' 91' ' ' GLN . . . -66.53 -52.43 45.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.244 -1.344 . . . . 0.0 111.256 178.294 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 95' ' ' LEU . . . . . 0.558 HD11 HG13 ' A' ' 12' ' ' VAL . 83.9 mt -56.79 -42.95 80.39 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 114.788 -1.096 . . . . 0.0 111.464 -179.257 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 96' ' ' GLN . . . . . 0.581 ' HA ' ' CG1' ' C' ' 99' ' ' VAL . 25.3 pt20 -74.8 -25.11 58.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.938 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 97' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' C' ' 100' ' ' GLN . . . -68.23 -30.6 73.72 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 177.421 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 98' ' ' GLN . . . . . 0.602 ' HB3' HG11 ' A' ' 19' ' ' VAL . 14.6 mm100 -73.31 -43.12 61.48 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 114.934 -0.633 . . . . 0.0 110.495 178.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 99' ' ' VAL . . . . . 0.705 HG21 ' HB3' ' B' ' 58' ' ' GLN . 0.2 OUTLIER -71.52 -34.18 52.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 C-N-CA 119.73 -0.788 . . . . 0.0 112.249 -179.399 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 100' ' ' GLN . . . . . 0.542 ' HG2' ' HA2' ' C' ' 97' ' ' GLY . 8.5 pt20 -65.32 -43.18 91.8 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.104 177.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 101' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' C' ' 98' ' ' GLN . 5.6 p-80 -78.5 -17.33 56.4 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.563 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 102' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' C' ' 98' ' ' GLN . 4.0 mt -74.2 -37.82 63.8 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 103' ' ' GLN . . . . . 0.648 ' HG2' HD11 ' B' ' 62' ' ' LEU . 63.8 mt-30 -72.46 -31.78 65.71 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.584 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 104' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' C' ' 101' ' ' HIS . . . -57.28 -53.79 54.16 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.543 177.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 105' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' C' ' 109' ' ' TYR . . . -59.32 -46.44 88.57 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.556 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 106' ' ' PHE . . . . . 0.657 ' HE2' ' HG ' ' B' ' 62' ' ' LEU . 0.7 OUTLIER -48.19 -32.94 7.73 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.795 0.684 . . . . 0.0 112.119 179.502 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 107' ' ' SER . . . . . . . . . . . . . 38.8 t -53.47 -35.7 60.85 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 120.913 0.387 . . . . 0.0 111.314 -179.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 108' ' ' GLN . . . . . . . . . . . . . 15.8 mp0 -84.93 -12.95 52.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.894 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 109' ' ' TYR . . . . . 0.797 ' O ' HG22 ' C' ' 112' ' ' VAL . 62.8 m-85 -103.43 -16.18 15.67 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.633 0.73 . . . . 0.0 109.418 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 110' ' ' LYS . . . . . 0.598 ' HA ' ' HE2' ' B' ' 69' ' ' TYR . 82.7 mttt -62.69 -18.46 62.49 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.195 -0.912 . . . . 0.0 111.291 179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 111' ' ' LYS . . . . . 0.562 ' HA ' HD11 ' C' ' 114' ' ' LEU . 0.2 OUTLIER -101.65 21.85 13.74 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.313 -0.955 . . . . 0.0 111.868 179.046 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 112' ' ' VAL . . . . . 0.797 HG22 ' O ' ' C' ' 109' ' ' TYR . 4.4 m -118.47 -13.57 10.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 O-C-N 121.893 -0.505 . . . . 0.0 112.285 179.469 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 113' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' C' ' 114' ' ' LEU . 10.6 pt-20 -76.85 -28.83 55.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 114' ' ' LEU . . . . . 0.562 HD11 ' HA ' ' C' ' 111' ' ' LYS . 0.0 OUTLIER -90.84 -41.91 10.93 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.031 -0.986 . . . . 0.0 113.578 -175.492 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' C' C ' 115' ' ' PHE . . . . . 0.732 ' HB2' ' HD3' ' C' ' 116' ' ' PRO . 4.6 m-30 -45.48 -64.48 0.89 Allowed Pre-proline 0 N--CA 1.478 0.942 0 O-C-N 123.387 0.43 . . . . 0.0 111.599 -179.264 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 116' ' ' PRO . . . . . 0.732 ' HD3' ' HB2' ' C' ' 115' ' ' PHE . 98.0 Cg_endo -80.89 171.24 14.49 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.521 2.148 . . . . 0.0 111.521 178.691 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 117' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -116.47 -89.88 0.56 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.843 179.414 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 118' ' ' GLY . . . . . 0.717 ' HA3' ' HZ ' ' B' ' 75' ' ' PHE . . . 69.58 60.46 5.01 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.71 -0.757 . . . . 0.0 111.943 -179.82 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 119' ' ' GLY . . . . . . . . . . . . . . . 88.94 -97.17 2.29 Favored Glycine 0 N--CA 1.448 -0.538 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 -179.046 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 33.0 pt . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.46 -0.781 . . . . 0.0 110.169 178.895 . . . . . . . . 0 0 . 1 stop_ save_