data_2rur_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 2rur _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 121.287 0.565 . . . . 61.33 109.653 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 8' ' ' ARG . 59.8 mtt85 -127.28 117.17 21.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.345 -0.843 . . . . 73.52 109.788 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.52 137.08 57.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-N 116.327 -0.397 . . . . 72.11 110.378 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.419 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 36.6 ttt180 -112.31 125.84 54.62 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.464 -0.334 . . . . 75.52 110.183 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -143.23 139.18 30.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.0 0.429 . . . . 51.01 111.204 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.432 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 15.4 m -98.29 153.87 18.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.428 -0.953 . . . . 41.51 108.428 176.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 145.83 37.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.406 0.891 . . . . 71.12 113.406 -175.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.43 ' HG ' ' HB2' ' A' ' 65' ' ' SER . 10.4 tt -122.59 141.01 52.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.945 -1.025 . . . . 73.25 108.322 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.577 HD22 ' CD2' ' A' ' 111' ' ' HIS . 2.7 tm? -139.17 131.05 27.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.93 0.395 . . . . 70.42 110.944 -178.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.404 ' N ' HD23 ' A' ' 15' ' ' LEU . 73.4 t -123.63 126.17 72.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.786 -0.82 . . . . 75.2 108.786 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 25' ' ' SER . 60.8 mttm -71.74 171.48 11.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.063 0.459 . . . . 63.34 111.236 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -142.31 168.72 19.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.805 -0.634 . . . . 64.43 110.117 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.6 m -56.59 -34.63 67.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.896 0.702 . . . . 75.25 112.896 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -89.84 12.64 16.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.416 0.524 . . . . 75.52 112.416 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.5 m -74.59 154.17 38.68 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 110.335 -0.246 . . . . 62.32 110.335 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.15 -42.24 99.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.962 0.411 . . . . 61.14 111.111 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -106.41 104.7 51.61 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 109.51 -0.552 . . . . 74.42 109.51 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.482 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 86.6 Cg_endo -82.93 22.39 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.886 2.391 . . . . 73.32 112.36 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' HE3' ' A' ' 17' ' ' LYS . 25.8 p -144.44 155.72 43.87 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.699 -0.482 . . . . 72.32 109.699 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.9 p -136.27 -165.94 1.8 Allowed 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.773 0.32 . . . . 65.43 110.276 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -92.66 8.4 39.3 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.343 0.592 . . . . 71.35 109.868 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -134.35 -32.03 1.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.566 -0.743 . . . . 75.4 111.481 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -116.6 148.19 41.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.855 -0.424 . . . . 52.23 109.855 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -85.15 -39.81 17.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 64.31 110.74 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 25.4 pttm -143.77 134.93 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.925 -0.579 . . . . 75.11 110.527 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mm -88.63 94.08 4.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.176 -0.466 . . . . 74.22 110.143 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 m -82.54 -22.72 34.87 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.717 -0.674 . . . . 70.33 110.653 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -73.05 134.77 44.71 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.172 -0.467 . . . . 61.31 111.003 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.9 t -92.5 -171.16 2.69 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.311 -0.404 . . . . 73.21 110.23 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -52.15 -53.87 37.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.164 0.585 . . . . 62.13 111.783 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 13.7 mm-40 -64.39 -39.99 94.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.174 -0.466 . . . . 73.33 112.221 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.82 -37.9 87.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.897 0.379 . . . . 74.12 110.91 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.428 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -72.59 -35.79 67.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.107 0.48 . . . . 52.33 109.975 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 40.1 tp -62.55 -37.5 86.38 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.531 -0.759 . . . . 64.42 111.059 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 48.4 mt-10 -60.99 -42.42 98.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.106 178.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.3 -45.71 90.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.029 -0.532 . . . . 74.11 109.984 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.1 mm -54.45 -53.2 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.766 -0.652 . . . . 75.34 110.645 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -62.04 -35.33 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.049 -0.523 . . . . 73.44 110.99 179.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -61.33 -48.98 82.33 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.565 -0.614 . . . . 71.3 111.565 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 50' ' ' ILE . 15.8 m-85 -56.61 -51.42 68.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.869 0.366 . . . . 72.14 110.113 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 78.3 mt -55.89 -48.8 77.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 115.515 -0.766 . . . . 65.31 111.316 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.78 -42.11 92.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.286 -0.416 . . . . 73.42 111.493 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 45.1 mtpt -62.97 -42.26 99.78 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.794 0.33 . . . . 73.44 111.113 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.456 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 78.9 mt -64.98 -47.94 86.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.141 -0.481 . . . . 75.51 111.024 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -64.17 -32.93 74.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.722 0.296 . . . . 74.11 111.566 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.8 m -76.23 -28.37 57.15 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.801 0.334 . . . . 74.2 111.312 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.35 13.37 28.71 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.397 -0.906 . . . . 74.32 111.933 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.64 -46.49 63.19 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.531 -0.544 . . . . 64.52 109.531 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 36.7 mt-10 -145.28 177.38 8.85 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.576 -0.738 . . . . 74.51 109.807 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -118.55 157.31 27.57 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.01 -0.737 . . . . 72.33 109.01 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -55.16 -24.74 28.13 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.331 0.493 . . . . 52.42 112.331 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -55.21 -51.0 67.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.922 0.341 . . . . 73.42 111.922 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.0 p -70.51 -39.71 73.93 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 120.906 0.384 . . . . 63.21 110.992 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.402 HD12 ' CD1' ' A' ' 46' ' ' TYR . 3.6 mm? -64.15 -46.94 81.83 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.982 -0.553 . . . . 73.22 111.336 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.95 -10.37 59.73 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.256 0.465 . . . . 74.43 112.256 -178.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.611 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 40.5 m -101.49 -52.25 3.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 70.2 111.793 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -102.62 -2.57 28.12 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.01 0.744 . . . . 70.14 113.01 -174.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -128.69 16.68 6.39 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 120.827 0.346 . . . . 75.33 111.05 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB2' ' HG ' ' A' ' 14' ' ' LEU . 23.3 t -125.27 149.89 47.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 73.4 111.063 -178.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -92.0 -14.96 28.59 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.581 -0.736 . . . . 74.32 110.306 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.409 ' HG ' ' HB3' ' A' ' 15' ' ' LEU . 51.1 m -55.3 134.1 49.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.751 -0.659 . . . . 75.32 111.241 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.6 m -60.02 -25.83 65.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 74.4 110.808 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 m -68.64 -6.8 28.0 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.077 -0.511 . . . . 70.23 111.602 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.73 -29.1 58.93 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.669 0.387 . . . . 62.33 111.704 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -71.43 -17.32 62.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.05 0.453 . . . . 74.51 110.898 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 73' ' ' ARG . . . -114.16 30.03 7.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.84 -0.618 . . . . 52.21 109.922 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.611 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 86.8 mtm180 74.37 10.87 4.2 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.549 -0.751 . . . . 75.05 112.406 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.51 85.68 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.843 -0.694 . . . . 62.45 113.126 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 30.4 t70 -85.23 140.72 30.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.903 0.382 . . . . 74.51 111.247 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.5 mt -94.01 -12.2 29.16 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 75.22 110.645 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.419 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 81.09 -166.32 48.22 Favored Glycine 0 N--CA 1.436 -1.351 0 N-CA-C 111.169 -0.773 . . . . 52.31 111.169 -177.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.84 109.11 17.86 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.935 0.398 . . . . 72.13 110.412 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.9 p90 -115.93 176.45 5.08 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 116.211 -0.449 . . . . 74.21 110.21 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.5 t -121.54 -172.13 2.36 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 110.05 -0.352 . . . . 74.54 110.05 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -73.8 149.33 41.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.205 -0.452 . . . . 62.41 110.255 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.96 36.19 57.46 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.792 -0.718 . . . . 23.51 111.745 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -126.8 -22.91 3.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.663 0.268 . . . . 64.12 111.534 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.412 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 46.8 tpp -131.63 164.54 25.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.736 -0.211 . . . . 74.44 110.902 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -52.32 139.63 23.83 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.585 -0.279 . . . . 44.52 110.44 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.458 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 55.8 tptt -51.57 -51.45 69.46 Favored Pre-proline 0 CA--C 1.551 1.004 0 N-CA-C 113.408 0.892 . . . . 73.41 113.408 -176.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.458 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.7 Cg_exo -56.32 -28.62 72.97 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.073 1.848 . . . . 63.12 112.741 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.58 ' CE2' HG12 ' A' ' 113' ' ' ILE . 21.4 t80 -90.25 -52.33 4.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.161 -0.472 . . . . 75.33 110.346 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.27 -49.84 76.02 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.736 -0.665 . . . . 72.52 111.439 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.75 -32.7 74.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 73.31 110.725 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.636 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.34 -37.16 71.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.042 -0.526 . . . . 72.54 110.142 178.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.439 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 40.3 m -59.01 -45.19 91.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.276 -0.42 . . . . 73.22 110.595 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -69.82 -28.31 65.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.394 -0.366 . . . . 65.41 111.026 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.81 -30.91 59.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 62.45 111.073 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 89.8 mt -72.2 168.03 19.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.19 -0.459 . . . . 74.43 110.466 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -104.06 173.52 6.27 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.313 -0.403 . . . . 73.32 109.972 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.1 m -69.51 116.21 9.66 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.879 -0.415 . . . . 55.4 109.879 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.51 45.96 5.36 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.888 -0.885 . . . . 51.15 110.888 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.41 130.86 52.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.698 0.285 . . . . 73.32 110.768 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.2 ttp -109.3 108.28 18.81 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.114 -0.494 . . . . 71.34 109.754 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.7 t -73.25 155.9 39.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.777 -0.647 . . . . 62.03 110.653 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.42 -154.64 15.03 Favored Glycine 0 N--CA 1.435 -1.41 0 CA-C-N 115.775 -0.648 . . . . 53.24 112.231 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.79 104.57 0.69 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.054 2.503 . . . . 71.44 113.053 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.9 t -101.78 117.65 47.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 51.2 109.688 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.13 124.14 28.99 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.902 0.382 . . . . 72.45 110.996 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.534 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -135.0 -173.72 3.39 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 116.193 -0.458 . . . . 75.33 109.927 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.534 ' H ' HG22 ' A' ' 106' ' ' THR . 4.6 m-20 -49.61 -61.9 1.85 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.713 0.805 . . . . 72.45 112.699 -177.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.5 p -64.8 -37.23 86.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.459 0.54 . . . . 74.5 112.459 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 163.06 -139.19 5.75 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.635 -0.793 . . . . 72.3 112.009 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.5 mt -91.21 129.18 42.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 120.776 0.322 . . . . 71.04 110.145 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.577 ' CD2' HD22 ' A' ' 15' ' ' LEU . 10.7 m170 -116.69 143.81 45.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.106 -0.497 . . . . 74.34 110.996 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 52.2 mt -110.73 126.16 68.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 108.138 -1.06 . . . . 75.21 108.138 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.58 HG12 ' CE2' ' A' ' 88' ' ' PHE . 20.2 mt -108.18 116.44 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.65 0.262 . . . . 71.44 111.295 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.7 tp -113.5 101.65 9.55 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 110.018 -0.364 . . . . 74.32 110.018 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 92' ' ' SER . 75.0 ttt180 -84.7 106.78 16.51 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.669 -0.412 . . . . 75.23 109.976 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.1 p -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.065 -0.516 . . . . 74.34 110.719 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.359 -0.829 . . . . 64.31 110.322 179.851 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.393 0 CA-C-O 121.053 0.454 . . . . 72.13 110.295 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -111.75 111.32 22.21 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.562 -0.903 . . . . 74.44 108.562 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.93 160.74 8.77 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-O 121.133 0.492 . . . . 62.2 111.796 -174.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.538 ' HB3' ' CG ' ' A' ' 117' ' ' GLU . 67.0 ttt180 -133.27 122.57 24.1 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 109.236 -0.653 . . . . 74.52 109.236 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.449 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 58.5 m -134.78 145.41 48.37 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.074 0.464 . . . . 74.33 111.336 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -99.89 140.95 33.36 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.231 -1.026 . . . . 73.51 108.231 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.518 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 9.4 p80 -125.4 133.33 52.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.935 0.717 . . . . 74.41 112.935 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 6.5 tt -112.84 124.04 51.68 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.349 -1.352 . . . . 65.54 107.349 174.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -108.89 127.77 54.33 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 112.23 0.455 . . . . 51.43 112.23 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.3 p -118.03 114.0 43.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.354 -0.839 . . . . 52.35 108.943 174.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -85.16 175.62 8.86 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.031 -0.531 . . . . 63.4 111.166 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -145.15 165.59 27.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.108 -0.496 . . . . 73.13 110.701 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.41 ' HA ' ' O ' ' A' ' 32' ' ' ILE . 33.3 t -54.93 -52.21 63.68 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.682 0.614 . . . . 72.34 112.281 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -84.03 38.22 0.64 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.211 0.449 . . . . 52.41 112.211 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.4 t -91.54 162.63 14.45 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.973 -0.38 . . . . 73.41 109.973 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -12.52 60.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.228 0.537 . . . . 74.42 110.446 177.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -149.69 83.1 6.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.499 -0.773 . . . . 72.44 109.056 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -81.46 25.57 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.389 2.726 . . . . 53.14 112.576 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.0 p -122.9 138.9 54.53 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.522 -0.308 . . . . 71.51 110.67 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -136.11 -167.08 1.98 Allowed 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.421 -0.354 . . . . 75.32 110.285 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 68.6 p-90 -83.75 -19.51 35.01 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.257 -0.428 . . . . 74.23 110.429 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -102.73 -43.55 5.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.984 -0.553 . . . . 54.13 110.97 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -124.07 115.52 21.3 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.3 -0.63 . . . . 72.21 109.3 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -67.93 -31.2 70.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.393 -0.367 . . . . 74.04 110.605 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 20.6 ptmt -134.86 105.99 6.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.268 0.556 . . . . 75.21 111.02 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 19' ' ' SER . 28.4 mm -71.73 122.32 23.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.662 -0.699 . . . . 72.1 109.281 177.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.6 p -104.75 -17.85 14.47 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.653 0.263 . . . . 73.31 111.426 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -65.36 141.8 58.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.845 0.355 . . . . 73.21 110.327 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.9 t -97.59 -179.15 4.37 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.448 -0.342 . . . . 70.25 110.995 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -56.65 -47.64 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.911 -0.586 . . . . 62.32 111.464 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.502 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 10.8 mm-40 -59.18 -45.47 90.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.029 -0.532 . . . . 64.43 111.097 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.65 -38.84 92.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 54.21 110.505 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.546 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.12 -40.8 90.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 71.54 110.722 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.39 -38.98 89.01 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.244 -0.435 . . . . 71.33 110.433 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 49.2 mt-10 -63.54 -35.47 80.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 74.43 110.252 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.8 mt -70.02 -41.36 74.41 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.752 -0.658 . . . . 75.22 109.946 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.5 mm -53.51 -55.79 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.963 -0.562 . . . . 72.52 110.15 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.586 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.6 m-20 -57.26 -40.06 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.623 -0.717 . . . . 73.21 110.716 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.46 -46.83 93.28 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.98 -0.555 . . . . 71.11 112.181 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -60.62 -44.73 96.0 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.062 0.458 . . . . 74.14 109.909 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 43' ' ' ILE . 70.1 mt -56.88 -45.94 83.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-N 115.529 -0.76 . . . . 71.34 111.075 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 66.1 mm-40 -60.6 -44.76 95.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 72.31 110.979 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.469 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 66.4 mttm -62.18 -40.96 97.79 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.066 -0.516 . . . . 54.23 111.63 -177.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.5 mt -72.27 -47.82 51.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.184 -0.462 . . . . 63.04 111.475 -178.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.49 -26.6 65.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.526 0.565 . . . . 73.25 112.526 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -85.07 -1.19 56.56 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.879 0.371 . . . . 72.12 111.274 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.44 75.43 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.788 -0.72 . . . . 31.15 112.417 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -84.54 -54.98 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.449 -0.575 . . . . 73.33 109.449 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.469 ' OE2' ' HD3' ' A' ' 49' ' ' LYS . 43.3 mt-10 -133.37 176.48 8.49 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.23 -0.895 . . . . 74.24 109.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.482 ' O ' HD11 ' A' ' 60' ' ' LEU . 3.1 p30 -122.77 165.26 16.87 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.244 0.545 . . . . 75.11 111.683 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.5 t80 -61.84 -43.72 98.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.176 -0.92 . . . . 75.52 111.82 -176.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.468 ' CD ' HH21 ' A' ' 73' ' ' ARG . 45.6 mt-10 -64.29 -42.83 96.22 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.282 0.475 . . . . 72.21 112.282 -176.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.9 t -66.58 -34.93 79.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.136 0.494 . . . . 72.14 110.191 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.482 HD11 ' O ' ' A' ' 56' ' ' ASP . 10.5 mp -77.84 -29.69 50.63 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.894 -0.594 . . . . 73.32 111.11 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.96 -49.2 77.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.774 0.321 . . . . 74.45 111.281 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.454 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 26.4 m -75.13 12.04 1.0 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.431 0.53 . . . . 51.3 112.431 -178.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -133.77 -57.51 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.398 . . . . 74.32 111.731 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -93.61 21.27 6.49 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.925 -0.579 . . . . 74.02 112.439 -174.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.3 t -118.09 142.43 47.42 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.347 -0.541 . . . . 54.41 110.468 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -97.54 12.57 32.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.891 -0.595 . . . . 74.03 110.473 -178.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 36.1 t -98.38 144.4 27.8 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.211 -0.449 . . . . 64.53 110.807 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.1 m -71.14 -16.25 62.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 74.25 110.177 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -73.33 -6.78 48.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.019 -0.537 . . . . 74.31 110.693 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 62' ' ' SER . . . -67.09 -25.17 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.961 -0.563 . . . . 60.32 109.897 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -64.57 -35.04 79.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.343 -0.844 . . . . 75.22 109.488 177.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.0 19.08 3.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.538 -0.756 . . . . 70.23 110.894 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.468 HH21 ' CD ' ' A' ' 58' ' ' GLU . 18.9 mtp180 69.61 8.07 6.55 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.273 0.629 . . . . 72.35 111.785 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.19 -9.75 68.72 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.929 -0.653 . . . . 61.34 113.085 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.1 123.93 30.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.017 0.436 . . . . 62.14 111.535 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.3 mt -90.54 -25.38 20.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.677 -0.692 . . . . 73.23 111.028 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.52 -169.54 16.34 Favored Glycine 0 N--CA 1.434 -1.463 0 N-CA-C 111.072 -0.811 . . . . 45.14 111.072 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.57 109.91 19.45 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.077 0.465 . . . . 74.43 111.197 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -118.25 177.13 4.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.922 -0.581 . . . . 73.23 110.118 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.4 t -141.41 176.49 8.82 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.864 -0.421 . . . . 74.15 109.864 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.61 ' O ' ' HD2' ' A' ' 81' ' ' ARG . 6.9 ppt_? -60.42 128.79 38.42 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.37 0.605 . . . . 72.31 111.733 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 111.82 12.0 15.43 Favored Glycine 0 N--CA 1.437 -1.278 0 CA-C-N 115.317 -0.856 . . . . 72.15 111.354 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.97 -33.33 3.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.885 0.374 . . . . 74.43 110.907 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.449 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 44.1 tpp -112.62 165.31 12.38 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.827 0.346 . . . . 61.02 111.447 -176.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -74.57 148.49 40.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 61.45 110.052 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.2 tptt -40.69 -55.45 4.49 Favored Pre-proline 0 N--CA 1.484 1.248 0 N-CA-C 114.559 1.318 . . . . 74.35 114.559 -175.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 14.8 Cg_endo -55.77 -29.02 69.86 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.731 2.287 . . . . 73.14 113.787 -176.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.501 ' CE2' HG12 ' A' ' 113' ' ' ILE . 10.3 t80 -100.53 -39.76 7.76 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.062 0.458 . . . . 72.42 110.092 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.86 -64.28 0.96 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 75.32 111.414 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.35 -35.41 77.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.847 -0.615 . . . . 73.23 111.391 -176.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.543 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -65.41 -33.34 75.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 73.45 111.237 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.449 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 71.9 m -64.4 -28.48 69.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.012 0.434 . . . . 74.1 111.536 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.86 -7.27 57.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 75.52 110.569 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.72 -3.59 23.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.979 -0.555 . . . . 74.51 111.466 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.5 mt -99.96 135.97 40.58 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 74.32 111.137 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -98.15 166.53 11.37 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.787 -0.642 . . . . 74.41 110.382 178.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -57.28 123.25 14.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.878 0.371 . . . . 72.21 111.487 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.5 -6.99 77.96 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.76 -0.733 . . . . 72.11 112.28 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -93.24 143.92 25.8 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.989 -0.374 . . . . 73.1 109.989 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.7 ttp -135.08 136.16 41.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.202 -0.454 . . . . 73.25 110.935 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -99.6 123.0 43.45 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.962 -0.755 . . . . 72.34 108.962 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.35 -76.31 1.31 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.698 -0.763 . . . . 60.31 113.937 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.68 83.9 1.29 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.716 2.277 . . . . 74.45 113.862 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . 0.511 ' HB ' ' O ' ' A' ' 111' ' ' HIS . 90.1 t -116.6 102.85 14.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.155 -0.683 . . . . 53.44 109.155 175.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -83.59 122.69 28.92 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.131 0.491 . . . . 72.55 111.667 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.535 HG23 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -131.61 -168.49 2.03 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.857 -0.794 . . . . 73.43 108.857 178.338 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.535 ' H ' HG23 ' A' ' 106' ' ' THR . 5.5 m-20 -55.0 -56.08 23.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.449 0.537 . . . . 62.23 112.449 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.3 p -71.44 -30.63 66.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.775 0.657 . . . . 71.45 112.775 -177.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -138.33 6.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.311 -0.947 . . . . 62.43 111.892 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 49.3 mt -91.7 127.67 43.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 120.929 0.395 . . . . 71.21 110.528 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.511 ' O ' ' HB ' ' A' ' 104' ' ' VAL . 13.5 m-70 -110.56 128.96 55.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.894 -0.593 . . . . 73.41 109.886 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.518 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.6 mt -99.38 123.51 52.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.895 -0.779 . . . . 72.43 108.895 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.501 HG12 ' CE2' ' A' ' 88' ' ' PHE . 14.8 mt -107.37 113.9 44.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.138 -0.483 . . . . 73.25 110.982 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 54.0 tp -104.55 123.81 48.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.554 -0.294 . . . . 74.44 110.54 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -87.58 99.16 11.84 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.833 -0.432 . . . . 70.21 109.833 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.5 p -80.87 -46.09 15.81 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.968 -0.56 . . . . 72.21 111.699 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . 0.538 ' CG ' ' HB3' ' A' ' 10' ' ' ARG . 70.8 mm-40 . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.695 -0.669 . . . . 75.44 111.045 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.747 0.308 . . . . 71.55 110.479 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -106.98 142.14 37.07 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.657 -0.497 . . . . 73.11 109.657 177.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.539 HG12 ' NH1' ' A' ' 115' ' ' ARG . 25.9 m -139.38 129.46 31.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 120.878 0.37 . . . . 71.44 111.384 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 0.7 OUTLIER -100.24 107.38 19.2 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 107.806 -1.183 . . . . 75.04 107.806 171.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.3 m -133.32 144.7 49.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.806 -0.634 . . . . 74.51 111.367 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -103.52 155.8 18.25 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.536 -0.913 . . . . 73.15 108.536 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.5 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.2 p80 -137.68 141.57 41.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.861 0.689 . . . . 74.44 112.861 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.501 HD22 ' N ' ' A' ' 15' ' ' LEU . 7.4 tt -115.44 143.23 45.6 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.796 -1.187 . . . . 74.24 107.796 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.52 HD11 ' CE1' ' A' ' 111' ' ' HIS . 40.7 tp -126.8 124.65 40.16 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.998 0.427 . . . . 74.25 111.9 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.1 t -112.81 118.39 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 115.445 -0.798 . . . . 74.34 109.056 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -86.5 -173.99 4.79 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.5 0.667 . . . . 74.42 111.284 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -160.65 172.96 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.062 -0.972 . . . . 72.33 108.498 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.7 m -54.05 -42.52 69.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.922 0.342 . . . . 64.2 111.922 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -88.43 54.95 3.22 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 75.21 111.597 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 t -108.03 170.07 8.23 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.827 -0.434 . . . . 73.31 109.827 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.505 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -73.28 -30.3 63.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.358 0.599 . . . . 71.11 109.923 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -134.81 94.81 16.17 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.555 -0.748 . . . . 75.11 109.45 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.448 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 85.6 Cg_endo -80.01 33.69 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 74.43 112.263 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -143.66 126.57 16.27 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.937 -0.574 . . . . 73.51 109.741 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.3 m -135.6 175.64 9.41 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.398 -0.364 . . . . 72.02 110.627 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -73.28 -14.0 61.23 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.191 -0.459 . . . . 75.32 111.203 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -91.15 -44.24 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 74.23 110.548 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -136.31 134.45 37.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.928 -0.578 . . . . 65.21 110.192 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.43 -47.84 83.94 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.069 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 60.7 pttt -126.66 113.43 16.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.051 0.453 . . . . 70.4 110.485 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.45 104.14 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.703 -0.681 . . . . 74.21 110.199 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.5 m -114.63 96.44 5.75 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 116.017 -0.538 . . . . 73.21 110.221 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -167.47 134.35 2.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.822 -0.626 . . . . 65.4 110.09 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 t -74.99 174.74 8.9 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.735 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -58.05 -38.18 75.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.824 0.345 . . . . 74.54 110.577 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.7 mt-10 -58.02 -46.39 85.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.784 -0.644 . . . . 74.11 110.772 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 74.5 mm-40 -59.96 -43.46 95.04 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.14 111.104 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.12 96.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.02 -0.536 . . . . 74.32 110.254 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.7 tp -63.73 -43.76 95.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.671 -0.695 . . . . 63.14 110.667 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 64.6 mm-40 -59.95 -43.03 95.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.08 -0.509 . . . . 73.52 110.754 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 83.9 mt -63.89 -48.71 75.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.331 -0.395 . . . . 75.04 110.664 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.6 mm -55.49 -56.98 9.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.076 -0.511 . . . . 63.03 111.053 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 39.7 m-80 -60.07 -35.95 76.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.266 -0.425 . . . . 71.24 110.892 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.31 -49.48 75.73 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.768 -0.651 . . . . 24.42 111.979 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.402 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 26.6 m-85 -61.24 -47.1 87.62 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.978 -0.378 . . . . 74.32 109.978 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.7 mt -51.12 -51.48 21.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.73 -0.668 . . . . 63.32 111.21 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 68.4 mm-40 -63.18 -40.11 96.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.485 -0.325 . . . . 73.33 111.149 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -62.39 -47.14 85.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.945 0.402 . . . . 63.43 110.957 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.77 -46.02 83.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.914 -0.584 . . . . 75.12 111.369 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -64.45 -38.55 91.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.431 -0.349 . . . . 54.21 111.527 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.1 t -70.62 -20.86 62.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.9 0.381 . . . . 64.31 110.836 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 94.3 18.4 36.41 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.68 -0.771 . . . . 63.32 112.452 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.2 -66.46 0.54 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.184 0.516 . . . . 71.13 111.053 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -137.38 161.88 35.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.518 -0.765 . . . . 73.44 110.692 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -78.7 144.87 34.9 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.048 -0.524 . . . . 74.22 112.089 -177.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.04 -41.73 94.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.662 -0.699 . . . . 74.52 110.055 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -59.83 -33.26 71.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.813 -0.631 . . . . 75.42 110.755 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.9 t -77.89 -34.52 51.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.985 -0.552 . . . . 72.21 110.619 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 99.1 mt -76.71 -40.85 47.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.475 -0.33 . . . . 75.44 111.157 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.58 -16.44 63.86 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.252 0.464 . . . . 75.34 112.252 -177.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.5 p -95.08 -4.65 45.95 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.739 0.304 . . . . 65.13 111.447 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -126.01 -58.68 1.37 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 120.872 0.368 . . . . 70.34 111.909 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.402 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 88.5 m-85 -93.94 38.4 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.257 -0.429 . . . . 72.31 112.058 -174.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -121.63 128.62 52.11 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.198 -0.668 . . . . 65.34 109.198 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -69.37 -28.72 66.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.089 0.471 . . . . 74.25 110.755 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 p -61.83 143.98 55.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 65.22 111.295 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.2 m -74.56 -8.55 56.7 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.195 0.522 . . . . 73.42 110.742 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.7 m -70.46 -4.47 22.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 62.22 111.058 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.53 -32.57 51.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.018 -0.537 . . . . 72.41 111.889 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -66.24 -33.28 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 72.53 110.74 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.62 7.48 36.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.64 -0.504 . . . . 61.43 109.64 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? 64.92 18.37 11.46 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.342 -0.844 . . . . 74.4 110.87 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 67.76 19.88 71.75 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.719 -0.673 . . . . 50.32 112.577 -179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.74 139.05 31.06 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.872 0.336 . . . . 63.22 111.14 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.0 mt -115.21 2.38 14.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.171 -0.468 . . . . 73.24 110.766 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.547 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 71.63 -154.94 51.84 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.36 -0.924 . . . . 72.33 111.062 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -91.87 108.39 19.89 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.859 0.362 . . . . 70.23 110.299 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.42 171.93 7.53 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.156 -0.474 . . . . 71.54 110.675 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.2 t -160.7 171.66 18.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.826 0.346 . . . . 71.45 111.43 -177.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 64.48 -82.38 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.31 1.044 . . . . 73.34 112.91 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.465 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -174.43 86.68 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.581 -0.819 . . . . 21.35 112.134 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -102.07 -24.07 14.0 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.483 -0.562 . . . . 54.4 109.483 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.403 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 35.8 tpp -113.86 172.12 7.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.54 -0.754 . . . . 71.25 109.517 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.96 141.56 33.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.45 0.167 . . . . 72.25 111.221 178.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.426 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.5 tptm -50.32 -50.5 70.46 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 113.645 0.98 . . . . 64.53 113.645 -176.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.426 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 77.0 Cg_exo -52.52 -35.32 66.18 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 121.993 1.796 . . . . 71.32 112.262 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.403 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 38.1 t80 -82.11 -50.14 9.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.746 -0.661 . . . . 73.01 110.308 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.465 ' HG2' ' HA2' ' A' ' 82' ' ' GLY . 2.5 tp10 -61.25 -30.04 70.21 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.857 -0.61 . . . . 71.1 111.036 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.6 -29.68 70.2 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.756 -0.657 . . . . 75.15 110.376 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.57 -24.48 21.71 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.771 -0.65 . . . . 61.34 110.922 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 m -58.82 -41.18 86.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.987 0.422 . . . . 64.44 111.077 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -91.24 12.84 18.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 74.13 111.179 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.47 -26.56 26.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.726 0.298 . . . . 72.23 111.26 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.35 127.77 32.5 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.255 -0.429 . . . . 75.15 110.497 -178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -86.01 -67.21 0.83 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.267 -0.424 . . . . 75.44 111.145 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 65.3 m -138.67 108.06 6.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.61 -0.268 . . . . 73.12 111.34 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.559 ' HA2' ' O ' ' A' ' 115' ' ' ARG . . . 51.56 44.5 53.87 Favored Glycine 0 C--N 1.332 0.337 0 CA-C-N 115.926 -0.579 . . . . 72.55 113.163 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -106.77 161.48 14.63 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 122.692 -0.299 . . . . 74.42 110.745 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.4 ttp -124.7 135.6 53.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.201 -0.454 . . . . 54.5 110.239 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.8 t -89.79 151.39 21.82 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.613 -0.514 . . . . 74.33 109.613 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.54 -144.92 4.59 Favored Glycine 0 N--CA 1.44 -1.04 0 C-N-CA 121.011 -0.614 . . . . 34.43 112.756 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.87 103.36 1.0 Allowed 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.67 2.247 . . . . 73.3 113.184 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -92.89 109.58 21.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.054 -0.521 . . . . 71.45 109.669 177.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -82.28 127.89 33.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.283 -0.417 . . . . 75.23 111.457 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 38.8 p -138.08 -166.16 1.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.806 -0.634 . . . . 61.54 110.165 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -70.43 -47.3 61.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.791 0.329 . . . . 72.1 111.33 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -69.45 -37.77 77.5 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.227 -0.442 . . . . 75.33 111.377 -177.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.93 -138.95 5.68 Favored Glycine 0 N--CA 1.441 -0.993 0 C-N-CA 120.766 -0.73 . . . . 70.04 111.696 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.5 mt -108.4 135.9 45.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 110.107 -0.331 . . . . 71.34 110.107 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.52 ' CE1' HD11 ' A' ' 15' ' ' LEU . 39.7 m-70 -120.4 152.59 37.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.717 0.294 . . . . 74.23 110.784 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 62.9 mt -115.46 128.3 72.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.004 -1.11 . . . . 72.01 108.004 173.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.8 mt -116.24 123.08 71.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.542 0.21 . . . . 72.01 111.112 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.0 tp -120.45 120.96 37.43 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.619 -0.264 . . . . 72.2 111.07 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.559 ' O ' ' HA2' ' A' ' 98' ' ' GLY . 18.8 ttt180 -89.08 119.36 29.52 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.576 -0.898 . . . . 71.53 108.576 175.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 m -85.82 -12.9 49.67 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 120.852 0.358 . . . . 75.31 111.344 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.58 -0.724 . . . . 74.24 110.858 -179.746 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.811 0.339 . . . . 72.22 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -117.59 121.95 42.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.302 -0.408 . . . . 65.5 110.559 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.5 m -136.23 150.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 116.247 -0.433 . . . . 72.13 110.714 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -110.44 114.71 28.35 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.914 -0.773 . . . . 62.54 108.914 176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m -129.01 152.55 48.5 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.25 0.548 . . . . 72.3 111.677 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -104.71 149.93 25.17 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.245 -1.02 . . . . 75.33 108.245 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -139.81 149.29 43.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.706 0.632 . . . . 72.02 112.706 -176.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.507 ' HA ' ' OG ' ' A' ' 65' ' ' SER . 8.8 tt -118.49 131.43 56.25 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.361 -0.977 . . . . 73.15 108.361 175.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.606 ' O ' ' HA ' ' A' ' 65' ' ' SER . 2.6 tm? -123.69 112.12 17.0 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.847 0.356 . . . . 71.22 110.535 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.99 122.23 64.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.429 0.633 . . . . 70.55 110.605 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -85.03 177.46 7.92 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.597 -0.729 . . . . 75.23 110.922 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.32 173.85 15.07 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.015 -0.539 . . . . 71.45 110.371 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.1 p -56.64 -53.59 55.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.258 0.466 . . . . 74.5 112.258 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -89.83 47.16 1.43 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.12 0.486 . . . . 73.5 110.696 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.2 t -92.3 173.91 7.57 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.977 -0.556 . . . . 42.53 110.419 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.44 ' HD2' ' OD1' ' A' ' 107' ' ' ASP . 46.6 ttt180 -68.89 -22.38 64.19 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.494 -0.928 . . . . 74.34 108.494 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.4 ' C ' ' H ' ' A' ' 25' ' ' SER . 24.2 tpp180 -150.46 98.61 3.24 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 114.562 -1.199 . . . . 71.42 108.746 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.402 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 71.8 Cg_endo -76.14 26.07 0.42 Allowed 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.214 2.609 . . . . 73.11 112.971 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.4 ' H ' ' C ' ' A' ' 23' ' ' ARG . 30.9 m -130.92 147.39 52.56 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.986 -0.552 . . . . 72.31 109.565 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.4 p -134.31 -178.42 5.04 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.88 0.371 . . . . 72.41 110.337 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 66' ' ' ASP . 44.4 p-90 -81.53 -0.78 43.57 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.587 -0.523 . . . . 75.32 109.587 175.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -102.36 -52.55 3.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.565 -0.743 . . . . 73.25 110.261 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -132.65 165.23 24.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.34 111.462 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.69 -38.91 28.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.034 -0.53 . . . . 53.12 111.184 -177.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 17.9 ptmt -135.67 125.58 25.79 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 120.936 0.398 . . . . 54.31 111.172 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.15 122.07 34.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.992 -0.549 . . . . 75.14 109.811 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.0 m -86.84 -40.44 14.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.579 0.228 . . . . 74.54 111.104 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -63.33 125.87 25.57 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.364 0.602 . . . . 75.33 111.804 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -81.85 171.25 14.71 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.737 -0.665 . . . . 75.23 109.903 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -58.82 -33.48 70.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.887 0.375 . . . . 74.33 110.575 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.43 -41.97 98.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.91 -0.586 . . . . 75.45 110.807 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -71.25 -39.74 71.45 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.966 -0.561 . . . . 71.32 110.466 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.39 -40.22 96.63 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.669 -0.696 . . . . 71.43 110.823 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.87 -43.76 77.44 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.144 -0.48 . . . . 73.25 111.603 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -58.45 -45.96 87.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.166 0.507 . . . . 62.3 110.287 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.77 -46.56 74.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.5 -0.773 . . . . 64.3 110.563 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.2 mm -56.55 -53.67 38.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.896 -0.593 . . . . 70.03 111.283 -179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -54.72 -45.27 74.03 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 120.976 0.417 . . . . 75.14 110.664 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.73 -54.14 40.1 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.461 -0.791 . . . . 73.22 112.52 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.52 ' O ' HG13 ' A' ' 50' ' ' ILE . 28.5 m-85 -57.36 -46.1 83.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 111.71 0.263 . . . . 64.43 111.71 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.401 HG21 ' HE2' ' A' ' 100' ' ' MET . 68.4 mt -55.17 -42.13 63.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 121.053 0.454 . . . . 75.21 110.871 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -74.34 -37.76 63.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.18 -0.464 . . . . 71.3 111.194 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 93.5 mttt -66.84 -33.78 76.37 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.472 -0.331 . . . . 73.23 111.131 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.589 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 89.5 mt -63.55 -43.07 98.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.966 0.412 . . . . 73.01 110.135 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -76.07 -1.67 27.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.068 -0.515 . . . . 75.11 111.139 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.4 t -103.24 -1.96 28.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.101 -0.5 . . . . 74.31 110.118 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.48 2.38 90.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.996 -0.621 . . . . 74.14 113.06 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -68.56 -65.49 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.993 0.425 . . . . 52.34 110.554 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.589 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 61.3 mm-40 -119.64 151.53 38.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.887 -0.597 . . . . 74.35 110.139 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -97.6 152.87 18.61 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.355 -0.609 . . . . 54.54 109.355 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -53.8 -40.09 66.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.527 -0.306 . . . . 75.43 111.711 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -65.85 -19.34 65.84 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 73.03 111.621 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 t -75.44 -38.0 59.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.108 0.48 . . . . 54.54 110.444 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.15 -40.64 13.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.122 -0.49 . . . . 63.45 111.112 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.67 -32.12 68.82 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.131 0.419 . . . . 62.21 112.131 -177.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 28.6 p -82.66 -14.39 54.76 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.248 0.462 . . . . 54.34 112.248 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -124.12 18.23 9.18 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.324 0.49 . . . . 74.53 112.324 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -139.31 -42.06 0.46 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 111.801 0.297 . . . . 64.51 111.801 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.606 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.6 m -64.57 132.09 48.86 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.176 0.512 . . . . 74.34 112.365 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.487 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . 20.8 t70 -84.6 -22.46 29.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.791 -0.641 . . . . 74.43 109.444 174.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -59.34 151.44 23.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.218 -0.901 . . . . 73.34 110.984 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.2 m -61.25 -13.12 16.29 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.278 0.473 . . . . 51.41 112.278 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 m -76.87 -6.19 51.41 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.592 -0.276 . . . . 70.35 111.186 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.421 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -55.93 -54.78 40.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.912 0.387 . . . . 72.01 111.337 -178.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -71.69 -8.41 53.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.941 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.78 13.75 32.63 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.913 -0.585 . . . . 42.04 110.174 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 69.91 15.71 7.8 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.267 -0.879 . . . . 71.12 112.57 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.77 -22.17 41.64 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.124 -0.56 . . . . 72.41 113.031 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.24 131.38 49.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.718 0.636 . . . . 74.53 112.718 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.41 -18.39 16.75 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 72.42 111.04 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.61 -175.43 40.56 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 110.898 -0.881 . . . . 51.54 110.898 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.79 122.53 24.2 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.904 0.352 . . . . 63.33 110.732 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -133.91 179.2 6.39 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.341 -0.39 . . . . 74.13 110.399 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -133.21 175.82 9.05 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 120.749 0.309 . . . . 64.13 110.317 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -78.78 156.38 28.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 74.14 111.391 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.01 28.38 28.67 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 116.051 -0.522 . . . . 74.54 111.961 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -127.91 -51.8 1.33 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.748 0.277 . . . . 75.11 111.748 -178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -91.91 175.61 6.82 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.749 0.309 . . . . 52.4 110.793 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -65.28 139.33 58.6 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.762 -0.459 . . . . 73.31 109.762 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.474 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.0 tptm -51.37 -52.06 63.07 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 113.456 0.91 . . . . 73.04 113.456 -175.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.6 Cg_endo -53.57 -27.33 40.73 Favored 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.419 2.079 . . . . 64.21 112.906 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -93.28 -50.86 5.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.089 0.471 . . . . 71.41 110.56 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.94 -46.24 90.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.64 -0.709 . . . . 64.52 111.324 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.29 -40.14 89.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.081 -0.509 . . . . 73.45 110.608 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.29 -31.97 71.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.874 -0.603 . . . . 74.12 110.804 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 m -68.65 -46.09 70.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.12 -0.491 . . . . 72.54 110.853 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -77.18 -10.23 59.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 74.25 111.619 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.23 8.51 32.74 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.116 0.484 . . . . 63.33 110.496 178.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 79.3 mt -101.57 131.75 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.857 -0.61 . . . . 64.34 110.581 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.5 mtm180 -76.87 172.75 12.63 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.269 -0.423 . . . . 71.44 110.106 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.0 m -55.42 111.88 0.98 Allowed 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.033 0.444 . . . . 74.32 111.868 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.32 49.77 11.42 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.801 -0.636 . . . . 61.35 112.765 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -129.19 156.26 44.22 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.878 0.371 . . . . 62.13 110.995 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.401 ' HE2' HG21 ' A' ' 47' ' ' ILE . 40.1 ttp -118.3 136.12 53.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.887 -0.597 . . . . 70.5 110.759 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.3 t -83.67 159.54 21.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.017 -0.538 . . . . 75.31 110.902 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.0 -171.09 44.28 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 111.33 -0.708 . . . . 32.25 111.33 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -65.44 107.01 0.93 Allowed 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.872 2.381 . . . . 72.22 112.774 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 91.1 t -89.68 120.56 38.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.63 -0.507 . . . . 70.52 109.63 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -95.85 133.37 40.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.057 0.456 . . . . 74.31 111.226 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 33.9 p -142.88 -173.71 3.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.882 -0.599 . . . . 74.45 110.189 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.44 ' OD1' ' HD2' ' A' ' 22' ' ' ARG . 2.1 p30 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 72.15 111.078 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.9 p -84.43 -41.83 16.24 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.442 . . . . 75.34 110.82 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.89 -149.84 18.67 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 120.696 -0.764 . . . . 60.41 111.945 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.4 mt -98.44 133.01 42.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.72 -0.474 . . . . 70.34 109.72 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -117.03 129.13 55.81 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.276 -0.42 . . . . 72.11 110.698 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 32.0 mt -107.49 137.5 38.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.784 -1.191 . . . . 60.24 107.784 173.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 24.4 mt -124.88 129.83 73.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.786 -0.366 . . . . 73.35 111.172 -176.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.3 tp -122.71 116.23 23.41 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.257 -0.645 . . . . 74.43 109.257 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -78.35 120.08 22.6 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.366 -0.533 . . . . 75.41 110.87 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 16.7 m -85.63 -60.73 1.94 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.581 -0.736 . . . . 63.12 109.898 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.31 -0.852 . . . . 62.45 110.199 179.686 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.518 0 CA-C-O 120.898 0.38 . . . . 65.13 110.843 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 mtm180 -99.34 106.76 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.273 -0.421 . . . . 73.42 110.275 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.7 m -134.81 154.18 36.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-O 121.077 0.465 . . . . 75.35 111.665 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -117.7 137.9 52.37 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.842 -0.799 . . . . 75.55 108.842 174.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.2 m -146.74 148.53 32.05 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.959 0.409 . . . . 75.32 110.933 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.5 m -102.06 148.52 25.28 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.202 -1.036 . . . . 65.31 108.202 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.8 p80 -136.75 132.21 34.47 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.833 0.679 . . . . 71.24 112.833 -176.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.21 124.8 50.83 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.985 -1.117 . . . . 72.53 107.985 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 111' ' ' HIS . 28.8 tp -120.8 124.24 44.59 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.02 0.438 . . . . 75.42 111.777 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.85 115.66 50.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.414 -0.812 . . . . 65.53 108.969 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -83.31 175.09 10.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.091 0.472 . . . . 74.3 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -152.12 162.3 41.31 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.832 -0.622 . . . . 74.31 110.048 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -56.28 -49.71 73.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.245 0.545 . . . . 74.01 111.13 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -80.01 40.28 0.47 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.677 -0.692 . . . . 74.01 111.638 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.7 t -105.98 -173.35 2.28 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.285 -0.635 . . . . 72.0 109.285 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 mtp85 -72.44 -23.92 61.14 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.294 0.568 . . . . 75.41 109.722 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HG2' ' H ' ' A' ' 25' ' ' SER . 19.4 ttm180 -146.59 114.13 4.39 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 71.04 110.055 177.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -87.18 21.89 1.0 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.921 2.414 . . . . 64.33 111.631 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.419 ' H ' ' HG2' ' A' ' 23' ' ' ARG . 15.6 m -126.3 148.1 49.6 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.768 -0.651 . . . . 62.1 109.877 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.8 t -146.94 -179.3 6.71 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.875 -0.417 . . . . 60.02 109.875 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 54.9 p-90 -84.71 -35.75 22.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.056 0.455 . . . . 74.22 110.573 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 3.3 ptm180 -81.0 -21.67 40.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.932 -0.576 . . . . 73.24 110.781 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -151.8 121.86 7.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.883 -0.599 . . . . 75.44 109.48 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.0 -41.69 90.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.307 -0.406 . . . . 74.41 111.345 -176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -122.71 109.24 14.0 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.159 0.504 . . . . 73.32 111.522 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.1 mm -79.04 105.8 8.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.744 -0.836 . . . . 71.43 108.744 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 47.6 p -87.75 -21.89 24.89 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.107 -0.497 . . . . 54.31 112.232 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.0 ptp85 -66.34 131.77 46.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.074 0.464 . . . . 75.21 111.104 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -86.76 -179.77 6.62 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.921 -0.582 . . . . 74.43 110.258 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.64 -43.31 99.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.68 0.276 . . . . 72.5 110.986 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.58 -40.07 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 74.34 110.869 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.93 -36.49 64.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 73.44 110.715 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.42 94.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.101 -0.5 . . . . 72.32 110.769 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.97 -42.12 93.44 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.385 -0.37 . . . . 72.11 110.91 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -65.73 -42.36 91.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 72.33 110.973 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.43 -52.34 58.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 71.33 110.925 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.7 mm -53.45 -56.5 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 O-C-N 123.457 0.473 . . . . 64.14 111.848 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.572 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 51.0 m-80 -61.99 -36.67 82.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.714 0.292 . . . . 73.14 111.101 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.541 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -62.44 -47.03 92.43 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.862 -0.685 . . . . 71.32 111.926 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 21.7 m-85 -57.38 -42.39 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.599 0.238 . . . . 74.5 110.907 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.47 -41.95 79.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.144 0.497 . . . . 41.32 110.505 178.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 71.8 mm-40 -66.73 -42.13 86.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.984 -0.553 . . . . 74.32 110.682 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.0 mtpp -58.92 -40.7 85.35 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.186 -0.461 . . . . 65.52 110.703 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 46' ' ' TYR . 82.3 mt -64.89 -42.87 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.703 -0.68 . . . . 74.32 110.996 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -69.09 -33.17 73.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.429 -0.351 . . . . 71.45 111.466 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -78.74 -16.03 57.71 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.01 0.434 . . . . 75.32 110.978 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.72 15.89 67.0 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.848 -0.691 . . . . 61.51 112.45 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -67.61 -58.29 4.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.21 0.529 . . . . 73.13 109.873 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -132.6 143.07 49.44 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.434 -0.803 . . . . 70.3 109.783 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -76.17 157.87 32.28 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 116.185 -0.461 . . . . 75.12 110.787 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -58.59 -43.9 89.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.506 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.387 -0.824 . . . . 70.15 110.488 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.3 t -65.24 -47.02 78.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.951 -0.568 . . . . 74.33 110.163 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.81 -37.16 81.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.004 -0.544 . . . . 70.01 111.075 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -65.53 -48.69 71.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.308 -0.406 . . . . 72.12 111.526 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -76.78 7.92 4.22 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.9 0.704 . . . . 51.41 112.9 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -135.6 -51.82 0.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.621 0.6 . . . . 71.4 112.621 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -96.27 -10.11 28.69 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.645 0.609 . . . . 71.12 112.645 -174.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.496 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 33.1 t -87.04 140.52 29.47 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.717 -0.393 . . . . 70.1 110.389 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.423 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 3.7 m-20 -93.46 13.71 20.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.996 0.427 . . . . 73.11 110.005 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.412 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 47.4 t -76.09 146.86 39.03 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.113 -0.494 . . . . 61.54 110.531 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.6 t -75.98 -20.49 57.83 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.854 -0.795 . . . . 73.23 108.854 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.38 -4.72 59.06 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.223 -0.899 . . . . 61.25 110.403 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 61' ' ' ALA . . . -58.13 -30.75 66.58 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.103 -0.499 . . . . 42.44 111.04 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -61.83 -26.48 68.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.967 -0.56 . . . . 73.24 110.608 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.73 24.44 8.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.941 -0.572 . . . . 65.2 110.135 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 68.2 13.71 9.12 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.911 -0.586 . . . . 72.12 111.274 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.71 12.01 78.48 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.576 -0.821 . . . . 62.02 111.848 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -65.88 126.17 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.923 0.392 . . . . 45.3 111.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -15.38 25.8 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.34 -0.615 . . . . 74.11 109.34 177.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.34 -166.56 48.03 Favored Glycine 0 N--CA 1.433 -1.561 0 C-N-CA 120.745 -0.74 . . . . 75.41 111.382 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -87.43 109.93 19.92 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.801 0.334 . . . . 62.31 110.261 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -116.06 151.36 35.68 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.135 -0.484 . . . . 73.2 109.993 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 13.4 m -149.81 177.48 9.77 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.586 -0.279 . . . . 75.54 111.124 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 67.17 10.75 7.95 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.529 -0.759 . . . . 63.32 112.38 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 67.71 31.85 76.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.032 -0.604 . . . . 72.31 112.882 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -82.26 79.05 8.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.155 0.502 . . . . 75.15 110.678 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.5 tpp -178.26 164.0 1.71 Allowed 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.964 -1.016 . . . . 60.2 108.376 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -58.0 139.72 53.88 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.573 0.225 . . . . 74.3 110.572 177.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 53.0 tptt -55.02 -48.63 95.56 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 113.113 0.782 . . . . 70.04 113.113 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 61.1 Cg_exo -53.12 -37.89 80.13 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 121.97 1.78 . . . . 72.44 111.874 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -76.26 -43.79 40.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.42 -0.809 . . . . 74.32 109.707 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.74 -50.21 74.71 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.668 -0.697 . . . . 71.12 111.472 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -54.6 -32.45 58.74 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.958 -0.564 . . . . 73.01 111.867 -177.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.562 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -86.77 -42.18 13.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.473 -0.33 . . . . 75.54 111.407 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -64.9 -44.85 88.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.96 0.409 . . . . 75.43 111.66 -177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -79.13 -0.79 33.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.304 -0.407 . . . . 74.54 111.34 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.63 -2.9 24.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.138 -0.483 . . . . 60.41 110.298 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.3 mt -84.5 140.8 31.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.062 -0.517 . . . . 73.41 110.778 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.99 -174.61 3.02 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.847 -0.615 . . . . 74.11 109.59 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.5 m -72.88 100.9 3.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.933 0.397 . . . . 74.5 110.449 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.23 19.77 20.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.879 -0.677 . . . . 52.3 111.771 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -104.84 147.29 27.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.831 0.348 . . . . 74.54 110.694 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.415 ' SD ' HD12 ' A' ' 114' ' ' LEU . 56.4 ttp -133.4 135.28 44.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.038 -0.528 . . . . 71.0 110.203 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.422 ' HB2' HD23 ' A' ' 95' ' ' LEU . 16.5 t -92.86 161.62 14.42 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.526 -0.546 . . . . 33.33 109.526 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.11 -144.25 6.89 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 120.648 -0.786 . . . . 64.03 112.19 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.4 103.62 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.501 2.134 . . . . 72.21 112.427 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.72 107.08 19.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.76 -0.459 . . . . 75.25 109.76 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -73.28 112.32 9.23 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.195 0.521 . . . . 74.15 111.037 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.402 HG23 ' H ' ' A' ' 107' ' ' ASP . 1.9 m -120.85 169.47 10.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.588 -0.733 . . . . 63.41 109.48 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.402 ' H ' HG23 ' A' ' 106' ' ' THR . 1.9 m-20 -51.71 -46.45 63.95 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.694 0.627 . . . . 63.12 112.694 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 p -77.7 -16.43 58.48 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.552 0.575 . . . . 54.54 112.552 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 146.15 -158.36 27.67 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.514 -0.851 . . . . 51.21 111.773 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 34.6 mt -87.73 126.2 41.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 120.858 0.361 . . . . 74.22 110.423 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.47 ' CD2' HD13 ' A' ' 15' ' ' LEU . 14.4 m-70 -115.23 133.35 56.11 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.107 -0.497 . . . . 73.13 110.274 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 42.3 mt -101.2 124.34 54.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 N-CA-C 107.606 -1.257 . . . . 70.51 107.606 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.1 mt -112.74 132.78 60.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 C-N-CA 120.813 -0.355 . . . . 75.33 111.32 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.415 HD12 ' SD ' ' A' ' 100' ' ' MET . 8.5 tt -133.65 131.39 39.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.193 -0.458 . . . . 64.43 109.983 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -118.69 130.26 55.74 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.922 -0.399 . . . . 64.32 109.922 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.33 0.57 14.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.858 0.318 . . . . 74.11 111.858 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 118.438 -0.791 . . . . 41.41 110.831 -178.897 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.607 0 CA-C-O 121.106 0.479 . . . . 64.01 109.732 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -133.0 127.41 34.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.404 -0.816 . . . . 70.02 109.912 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.9 m -131.9 166.75 28.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 116.328 -0.397 . . . . 44.45 110.029 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -123.75 128.28 49.35 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.699 0.285 . . . . 74.34 110.867 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -134.32 138.72 45.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.856 -0.611 . . . . 74.13 110.518 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.4 m -96.92 158.29 15.5 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.563 -1.273 . . . . 72.43 107.563 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.503 ' CD2' ' HG ' ' A' ' 76' ' ' LEU . 2.1 p80 -147.72 139.34 23.88 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.366 0.876 . . . . 64.33 113.366 -172.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.449 HD22 HD13 ' A' ' 112' ' ' ILE . 56.5 tp -116.72 116.48 27.6 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.155 -0.93 . . . . 73.44 108.762 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.534 HD11 ' CD2' ' A' ' 111' ' ' HIS . 16.3 tp -109.66 125.28 52.45 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.888 0.375 . . . . 73.44 110.967 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 p -123.92 136.12 61.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.626 -0.716 . . . . 61.23 109.85 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -84.71 179.7 7.3 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.457 0.646 . . . . 73.23 111.501 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -148.65 153.8 38.8 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.184 -0.917 . . . . 73.15 109.005 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.0 t -44.02 -51.82 7.53 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.997 0.81 . . . . 73.43 112.583 -176.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -90.08 65.31 6.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.092 0.473 . . . . 74.22 111.115 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -110.11 168.8 9.17 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.972 -0.558 . . . . 55.33 109.728 177.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -69.8 -24.92 63.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.159 0.504 . . . . 72.3 110.189 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -153.55 88.8 3.61 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.811 -0.632 . . . . 63.01 109.343 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.5 56.53 6.12 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 123.042 2.495 . . . . 61.43 112.546 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.5 m -137.33 125.23 22.66 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.303 -0.408 . . . . 73.11 110.344 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.5 m -127.4 176.79 7.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.761 0.315 . . . . 72.22 111.622 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -66.99 -31.14 71.51 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.452 0.538 . . . . 65.55 112.452 -178.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -86.61 -62.11 1.58 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.169 0.509 . . . . 73.42 109.791 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -112.35 127.61 56.05 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.809 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -82.01 -14.06 56.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.98 -0.555 . . . . 45.43 110.772 -178.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -123.58 139.44 54.0 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 65.13 109.429 176.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.09 102.26 13.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.958 0.408 . . . . 75.05 110.703 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.1 p -81.43 -41.6 21.61 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.943 -0.571 . . . . 61.12 110.301 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.5 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 8.4 ptt85 -53.09 117.54 3.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.504 -0.771 . . . . 74.12 111.964 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.3 t -82.37 -179.25 7.35 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.872 -0.604 . . . . 65.35 110.639 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -41.11 87.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 63.21 111.065 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.03 -45.47 94.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.421 -0.354 . . . . 74.13 111.051 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.506 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 47.5 mt-10 -65.69 -41.62 92.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.06 -0.518 . . . . 74.11 110.434 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.423 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -65.5 -35.77 81.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 72.03 111.148 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.63 -44.49 93.46 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.083 0.468 . . . . 74.5 109.815 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.84 -36.59 80.61 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.84 -0.618 . . . . 62.1 110.208 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.8 mt -62.2 -42.01 98.89 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.321 -0.4 . . . . 75.02 110.048 178.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 39' ' ' ALA . 31.6 mm -54.8 -54.43 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 116.224 -0.444 . . . . 74.02 110.201 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -60.66 -38.35 84.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.771 -0.65 . . . . 71.31 110.373 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -46.92 93.53 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.859 -0.61 . . . . 64.44 111.882 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.486 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.2 m-85 -61.39 -50.43 72.91 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.862 -0.422 . . . . 72.41 109.862 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.79 -48.94 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.816 -0.629 . . . . 52.31 111.165 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -39.61 89.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.257 -0.429 . . . . 70.13 111.27 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.465 ' HG3' ' OE1' ' A' ' 54' ' ' GLU . 41.9 tttp -67.27 -36.08 80.83 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 120.899 0.381 . . . . 64.31 110.73 -179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.503 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 91.4 mt -65.28 -47.05 88.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.552 -0.536 . . . . 71.44 109.552 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.77 -15.01 63.39 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.703 -0.681 . . . . 72.23 111.538 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.4 m -80.04 -11.77 59.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.952 0.406 . . . . 72.05 110.411 177.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.16 18.38 74.57 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.788 -0.72 . . . . 65.21 112.01 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.465 ' OE1' ' HG3' ' A' ' 49' ' ' LYS . 48.1 mt-10 -88.9 -68.35 0.78 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.107 0.479 . . . . 74.51 109.811 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 73.8 mm-40 -108.37 147.52 31.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.767 -0.652 . . . . 73.11 109.903 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -93.71 157.52 16.12 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.183 -0.673 . . . . 53.23 109.183 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -36.29 63.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.002 0.43 . . . . 74.43 110.814 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -60.76 -34.81 75.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.736 -0.665 . . . . 72.54 111.093 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.7 t -69.19 -44.76 71.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.171 0.51 . . . . 73.15 109.974 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.81 -45.81 80.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.741 -0.663 . . . . 72.03 110.531 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.417 ' HA ' HD13 ' A' ' 14' ' ' LEU . . . -70.24 -17.8 63.14 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.892 0.701 . . . . 43.31 112.892 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.7 m -99.01 -24.2 15.0 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.719 0.637 . . . . 72.51 112.719 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -121.27 -28.3 4.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.136 0.791 . . . . 71.13 113.136 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -105.81 5.2 30.6 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.114 0.413 . . . . 74.44 112.114 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -90.97 140.63 29.66 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.654 -0.418 . . . . 71.45 109.946 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -88.8 -1.4 58.07 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.205 0.526 . . . . 64.42 110.559 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.441 ' HB2' HD22 ' A' ' 15' ' ' LEU . 46.9 t -87.5 154.57 20.53 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.956 -0.566 . . . . 53.3 110.474 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 m -74.87 -9.05 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.415 0.626 . . . . 74.31 109.882 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.9 p -74.2 -5.78 43.95 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.499 -0.773 . . . . 74.13 110.93 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -29.0 68.87 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.041 -0.527 . . . . 44.03 109.99 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -68.98 -26.63 65.12 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.539 -0.755 . . . . 64.12 110.3 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.54 16.06 5.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.165 -0.471 . . . . 61.51 110.298 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.0 ttt85 69.0 17.53 8.57 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.601 -0.727 . . . . 75.55 110.434 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.27 71.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.613 -0.721 . . . . 61.12 113.137 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -124.94 135.31 52.71 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 122.614 -0.345 . . . . 74.12 110.943 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.503 ' HG ' ' CD2' ' A' ' 13' ' ' HIS . 75.5 mt -91.35 -11.22 38.53 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.302 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.77 -158.18 49.73 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.405 -0.902 . . . . 33.33 110.908 -176.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.9 117.44 27.9 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.84 0.352 . . . . 73.41 110.505 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -118.06 166.49 12.48 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 109.664 -0.495 . . . . 73.1 109.664 178.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -96.23 170.8 9.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.047 0.451 . . . . 72.22 111.243 -177.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -69.93 132.04 45.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.604 -0.725 . . . . 72.35 110.919 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.42 39.79 25.18 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.918 -0.658 . . . . 70.23 112.126 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -123.62 -4.69 8.19 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.158 0.429 . . . . 74.01 112.158 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 35.4 tpp -125.89 173.96 8.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.666 -0.414 . . . . 70.43 111.29 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -54.55 145.33 18.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.475 -0.33 . . . . 75.11 110.789 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 27.2 tptp -48.39 -54.46 25.7 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 113.457 0.91 . . . . 71.32 113.457 -176.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 29.4 Cg_endo -62.41 -26.79 76.9 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.12 1.88 . . . . 74.45 112.761 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -84.8 -43.23 14.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.144 0.497 . . . . 73.52 109.706 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.5 -50.98 70.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.063 -0.971 . . . . 73.33 110.922 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.18 -48.61 77.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.644 -0.707 . . . . 65.53 111.558 -178.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.72 77.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.186 -0.461 . . . . 72.25 112.043 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.434 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 71.7 m -59.04 -50.82 72.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.776 0.322 . . . . 63.45 111.459 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -79.2 -16.55 56.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.543 -0.299 . . . . 74.04 111.677 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.44 62.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.159 0.504 . . . . 43.24 109.73 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.7 mt -84.71 -171.38 3.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.566 -0.743 . . . . 74.44 109.9 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -148.09 -178.88 6.53 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.178 -0.675 . . . . 75.13 109.178 177.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 116' ' ' THR . 32.5 m -54.53 113.04 1.14 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.595 0.358 . . . . 74.45 111.957 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 97.36 -6.56 63.45 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.935 -0.65 . . . . 61.04 113.621 175.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -90.99 149.7 21.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.146 0.498 . . . . 61.2 111.863 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.6 ttp -131.05 131.51 44.3 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.474 -0.785 . . . . 71.03 110.323 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.2 t -87.21 168.29 13.35 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.685 -0.487 . . . . 74.21 109.685 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.57 -137.28 5.86 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.804 -0.712 . . . . 73.43 112.532 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.21 108.95 2.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.728 2.285 . . . . 63.0 113.388 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 74.4 t -102.97 104.79 17.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.258 -0.645 . . . . 54.04 109.258 175.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -76.11 122.88 24.93 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.262 -0.426 . . . . 75.32 111.445 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.506 HG23 ' H ' ' A' ' 107' ' ' ASP . 0.6 OUTLIER -127.42 -152.77 0.53 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 116.137 -0.483 . . . . 61.44 109.99 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.506 ' H ' HG23 ' A' ' 106' ' ' THR . 8.7 m-20 -71.4 -65.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.947 0.351 . . . . 75.15 111.947 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 43.3 t -64.15 -42.92 96.58 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.113 -0.494 . . . . 72.35 111.729 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -179.28 -145.02 6.05 Favored Glycine 0 N--CA 1.436 -1.312 0 C-N-CA 120.179 -1.01 . . . . 70.25 112.512 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.8 mt -96.54 137.95 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 110.171 -0.307 . . . . 75.1 110.171 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.534 ' CD2' HD11 ' A' ' 15' ' ' LEU . 12.7 m-70 -119.59 130.64 55.22 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.396 -0.365 . . . . 65.45 110.826 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.449 HD13 HD22 ' A' ' 14' ' ' LEU . 24.6 mt -101.28 130.88 50.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 107.648 -1.242 . . . . 61.25 107.648 172.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.0 120.24 62.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 112.095 0.406 . . . . 74.54 112.095 -175.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.6 tp -112.84 109.53 19.06 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.971 -0.751 . . . . 73.23 108.971 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 92' ' ' SER . 80.0 ttt180 -85.39 114.87 22.77 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.584 -0.446 . . . . 73.23 110.793 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.499 ' O ' HG22 ' A' ' 97' ' ' THR . 6.9 m -84.16 -44.65 13.77 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.913 -0.585 . . . . 73.44 110.425 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 . . . . . 0 C--O 1.243 0.726 0 CA-C-O 118.38 -0.819 . . . . 74.42 110.512 -178.36 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.571 -0.529 . . . . 54.23 109.571 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -125.73 113.42 17.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 73.43 109.418 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.8 m -111.83 148.4 15.04 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 116.386 -0.37 . . . . 54.03 110.901 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -126.18 129.15 48.44 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.289 -0.414 . . . . 75.5 110.103 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.434 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 61.7 m -138.9 155.57 47.97 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.754 -0.657 . . . . 64.44 110.345 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.2 m -98.35 142.48 29.93 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.973 -1.121 . . . . 74.41 107.973 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.408 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 1.3 p80 -127.24 129.99 48.79 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.887 0.699 . . . . 71.32 112.887 -175.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.43 ' HB3' ' HB ' ' A' ' 112' ' ' ILE . 2.9 tm? -105.71 127.32 53.01 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 106.491 -1.67 . . . . 63.25 106.491 175.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 108' ' ' SER . 38.3 tp -125.56 121.08 32.62 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.641 -0.424 . . . . 72.55 111.286 -178.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -137.18 130.81 44.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.507 -0.769 . . . . 65.01 109.729 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mttp -97.16 -179.97 4.71 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.165 -0.471 . . . . 75.44 111.206 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.43 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 3.4 p80 -153.5 -179.26 7.6 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.447 -0.575 . . . . 72.04 109.447 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 p -48.13 -46.15 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.598 0.561 . . . . 75.14 111.843 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.43 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 78.5 mm-40 -85.34 69.1 10.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.113 0.483 . . . . 75.03 111.51 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.9 t -144.99 157.78 44.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.068 -0.716 . . . . 71.24 109.068 176.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.88 -19.54 60.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.94 0.4 . . . . 75.44 111.308 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -123.78 94.94 45.28 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.31 -0.404 . . . . 75.24 110.321 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -91.53 28.4 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 123.083 2.522 . . . . 60.33 112.67 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -143.27 128.93 19.23 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.407 -0.36 . . . . 61.23 110.336 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.37 -168.72 1.85 Allowed 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.098 -0.334 . . . . 74.42 110.098 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 66.8 p-90 -86.26 -16.65 36.94 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.026 0.441 . . . . 73.11 110.006 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -100.41 -37.95 8.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 71.31 110.809 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -131.94 117.36 18.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.489 -0.56 . . . . 71.21 109.489 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 63.23 111.888 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -134.24 101.18 4.92 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.045 0.45 . . . . 62.41 110.509 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.18 93.17 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.993 -0.549 . . . . 73.13 110.173 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.9 p -88.8 -16.88 30.98 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.049 -0.523 . . . . 74.43 111.608 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -67.16 124.82 24.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.264 0.554 . . . . 71.31 111.815 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.2 t -84.28 -177.53 6.67 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.72 -0.673 . . . . 60.33 110.923 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -57.82 -42.02 83.44 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 122.794 0.438 . . . . 73.43 111.021 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -57.67 -44.17 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.1 111.328 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 27.1 mm-40 -69.7 -42.16 74.44 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.878 -0.601 . . . . 70.53 110.449 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.01 -44.24 97.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.662 -0.699 . . . . 72.24 111.482 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -58.47 -45.47 88.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.538 -0.301 . . . . 61.32 111.609 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -61.44 -34.02 74.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.894 0.378 . . . . 75.22 110.816 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.9 mt -72.29 -41.81 66.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.015 -0.539 . . . . 74.41 110.019 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.0 mm -58.65 -47.07 89.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.135 -0.484 . . . . 74.02 109.815 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.539 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 85.8 m-20 -57.48 -43.65 84.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 115.723 -0.672 . . . . 75.11 109.927 178.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.6 -41.28 97.24 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.722 -0.672 . . . . 74.23 112.243 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -61.94 -48.83 78.67 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 109.518 -0.549 . . . . 71.53 109.518 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.83 -42.96 87.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.368 -0.833 . . . . 74.11 110.702 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 81.3 mm-40 -58.52 -48.06 82.1 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 116.299 -0.41 . . . . 73.41 110.902 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -59.54 -41.78 90.83 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.894 0.331 . . . . 72.12 111.894 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 71.9 mt -72.22 -41.47 66.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 74.12 111.844 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -78.11 -40.07 39.37 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 72.03 112.373 -178.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.0 t -73.97 -26.3 60.4 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.596 0.236 . . . . 74.21 110.878 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.44 38.54 5.58 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.573 -0.822 . . . . 54.21 112.074 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.69 -49.55 7.07 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 72.1 110.226 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -143.38 173.7 11.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.787 -0.642 . . . . 72.2 110.305 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -99.15 153.97 18.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.136 -0.484 . . . . 71.5 110.215 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -55.52 -38.16 68.86 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.005 0.431 . . . . 64.2 110.264 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.498 ' OE2' ' HD2' ' A' ' 73' ' ' ARG . 35.5 mt-10 -61.68 -30.67 70.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.644 -0.707 . . . . 72.45 111.283 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.8 t -76.67 -28.93 56.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.347 0.594 . . . . 74.51 110.453 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -87.84 -47.94 8.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.781 -0.645 . . . . 64.31 111.081 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -19.98 64.03 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.925 0.713 . . . . 71.12 112.925 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.689 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 2.7 p -76.65 -20.79 56.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.196 0.813 . . . . 72.32 113.196 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -128.77 -22.53 3.24 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.931 0.715 . . . . 74.52 112.931 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -91.56 -10.85 39.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.658 0.614 . . . . 72.42 112.658 -177.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.414 ' OG ' HD23 ' A' ' 14' ' ' LEU . 34.3 m -84.41 136.21 33.96 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.998 -0.281 . . . . 63.22 110.244 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -84.96 -11.8 54.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.306 0.574 . . . . 53.02 109.913 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.424 ' HB2' HD22 ' A' ' 15' ' ' LEU . 30.9 t -79.6 159.7 26.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.317 -0.856 . . . . 74.02 110.89 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 17.0 m -70.05 -19.0 63.31 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.161 -0.472 . . . . 64.55 110.138 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.9 m -67.67 -5.03 13.87 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.969 -0.56 . . . . 73.33 111.421 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.689 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -51.99 -51.15 59.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.185 -0.461 . . . . 74.32 111.285 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.88 4.44 9.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.116 0.413 . . . . 64.05 112.116 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.3 12.34 37.33 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.964 -0.754 . . . . 71.32 108.964 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.498 ' HD2' ' OE2' ' A' ' 58' ' ' GLU . 75.9 mtm180 69.33 16.4 8.36 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.791 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.49 3.43 90.53 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.002 -0.618 . . . . 70.42 113.316 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -73.72 134.6 43.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.085 0.469 . . . . 71.43 111.025 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.526 HD22 ' O ' ' A' ' 76' ' ' LEU . 4.1 tt -101.69 -19.64 15.32 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.782 -0.821 . . . . 75.03 108.782 178.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.44 -176.38 48.2 Favored Glycine 0 N--CA 1.437 -1.272 0 CA-C-N 115.56 -0.745 . . . . 63.13 111.628 -178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.04 131.98 34.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 120.748 0.309 . . . . 75.2 110.235 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -133.27 154.44 50.68 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.913 -0.585 . . . . 74.53 110.02 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 p -95.56 -80.85 0.41 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 111.989 0.366 . . . . 72.31 111.989 -177.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -161.64 136.97 7.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 72.31 110.842 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.57 15.93 76.87 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.748 -0.66 . . . . 74.31 111.474 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -103.87 -36.38 7.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 72.41 110.824 -176.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' MET . . . . . 0.411 ' HE2' HD13 ' A' ' 76' ' ' LEU . 26.5 tpp -121.23 157.56 30.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.205 -0.452 . . . . 72.13 109.996 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -48.03 135.7 12.43 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 123.38 0.425 . . . . 73.41 111.464 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.496 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 12.7 tmtt? -48.6 -52.48 44.11 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 115.64 -0.709 . . . . 50.24 112.635 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.1 Cg_endo -53.54 -24.14 27.78 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.619 2.212 . . . . 72.31 113.413 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.561 ' CD2' HG12 ' A' ' 113' ' ' ILE . 31.1 t80 -99.42 -53.36 3.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.056 0.455 . . . . 74.32 110.586 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -59.86 -48.08 83.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.52 -0.764 . . . . 65.45 111.386 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -60.76 -45.09 95.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.115 -0.493 . . . . 73.42 111.683 -178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.92 66.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 63.42 111.351 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.434 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 67.5 m -65.84 -24.16 66.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.237 -0.438 . . . . 64.32 111.668 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -81.84 -27.51 33.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.412 . . . . 73.02 110.542 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.61 -28.08 37.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.863 -0.608 . . . . 73.45 110.887 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.8 mt -82.68 133.22 35.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.067 -0.515 . . . . 74.12 110.546 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -97.09 169.41 9.83 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.322 -0.399 . . . . 71.45 109.97 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.9 m -55.89 111.28 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.302 -0.408 . . . . 62.04 111.158 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.31 -13.28 23.54 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.692 -0.766 . . . . 42.21 112.691 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -91.0 154.63 19.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.908 0.385 . . . . 72.2 110.958 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.8 ttp -142.23 130.23 21.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.127 -0.488 . . . . 74.11 110.427 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.0 t -78.86 157.46 28.32 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.075 -0.512 . . . . 73.4 110.321 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.18 -155.88 22.78 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.811 -0.709 . . . . 72.1 111.776 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.02 105.73 1.41 Allowed 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.636 2.224 . . . . 74.44 113.232 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.2 110.8 21.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.921 -0.77 . . . . 74.24 108.921 175.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -83.92 122.47 28.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.214 -0.448 . . . . 75.33 111.937 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.5 p -142.45 178.57 7.51 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.793 -0.639 . . . . 73.55 109.779 178.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.21 -31.98 70.94 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.036 0.446 . . . . 73.55 110.865 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.514 ' O ' HD13 ' A' ' 15' ' ' LEU . 11.8 p -79.74 4.97 14.66 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.63 -0.713 . . . . 75.24 111.33 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.85 -158.44 14.28 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.845 -0.693 . . . . 70.01 112.389 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.4 mt -97.93 128.12 49.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 N-CA-C 109.837 -0.431 . . . . 74.23 109.837 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -110.9 125.54 53.76 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.496 -0.32 . . . . 75.24 110.812 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' A' ' 14' ' ' LEU . 59.0 mt -102.17 130.67 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.458 -0.942 . . . . 74.05 108.458 174.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' CD2' ' A' ' 88' ' ' PHE . 11.0 mt -110.79 107.43 22.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.652 -0.249 . . . . 73.01 111.202 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.9 tt -104.75 114.81 29.25 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.174 -0.676 . . . . 71.44 109.174 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -79.39 108.39 12.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.222 -0.444 . . . . 71.51 110.261 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.2 p -95.07 -64.07 1.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.644 0.979 . . . . 75.53 113.644 -176.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.344 -0.836 . . . . 74.42 111.765 -174.901 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 121.292 0.568 . . . . 70.34 109.877 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.466 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.6 mtt180 -107.07 117.51 34.26 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.257 -0.883 . . . . 74.24 110.021 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.3 m -124.54 148.66 28.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 CA-C-N 116.165 -0.471 . . . . 73.24 110.366 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.426 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.4 ttt180 -103.54 109.06 20.58 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 110.043 -0.355 . . . . 70.12 110.043 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.468 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 84.8 m -128.88 132.78 47.74 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.299 0.571 . . . . 74.14 111.318 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.8 m -98.1 142.77 29.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 108.247 -1.02 . . . . 73.02 108.247 176.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.485 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -133.91 129.06 35.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.452 0.908 . . . . 72.31 113.452 -176.58 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.4 tt -106.78 142.61 36.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 107.645 -1.243 . . . . 75.24 107.645 174.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 67' ' ' SER . 46.0 tp -123.75 134.05 53.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.883 0.327 . . . . 75.53 111.883 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.412 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 14.4 p -117.64 132.62 66.93 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-N 115.758 -0.655 . . . . 70.13 109.944 175.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.89 158.24 16.88 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.956 0.408 . . . . 73.34 110.171 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -139.98 158.25 44.36 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.11 -0.496 . . . . 75.12 109.735 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.2 t -43.76 -59.88 2.04 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.98 0.8 . . . . 74.43 112.356 -177.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -92.02 66.84 5.04 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.053 0.454 . . . . 71.34 111.12 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 t -116.0 173.74 6.41 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.067 -0.515 . . . . 75.1 109.621 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -56.51 -57.21 13.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 53.3 109.879 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -126.55 97.96 32.69 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 109.37 -0.604 . . . . 75.43 109.37 175.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -73.73 50.57 2.09 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.387 2.725 . . . . 62.5 112.295 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -140.82 152.39 45.13 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 116.038 -0.528 . . . . 53.22 110.172 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.3 p -154.99 -176.4 5.92 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.358 -0.608 . . . . 60.35 109.358 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -82.64 -3.38 56.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.352 0.596 . . . . 72.33 109.589 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.441 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 58.9 mtp180 -104.99 -43.64 5.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.791 . . . . 74.22 110.078 -178.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.414 ' HB3' HD13 ' A' ' 32' ' ' ILE . 62.8 tt0 -142.92 118.34 10.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.866 -0.606 . . . . 74.23 109.894 -178.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.36 -29.27 63.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.926 0.393 . . . . 70.25 111.164 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -123.1 94.11 4.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.232 0.539 . . . . 74.52 110.241 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.414 HD13 ' HB3' ' A' ' 29' ' ' GLN . 42.6 mm -68.73 104.01 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.501 -0.772 . . . . 63.45 111.39 -178.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.54 -24.07 20.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.044 -0.525 . . . . 74.21 111.001 177.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 ptt180 -60.64 118.22 6.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.898 -0.592 . . . . 75.4 110.303 177.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t -85.15 -174.72 5.4 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.767 -0.651 . . . . 74.53 112.098 -175.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -57.58 -50.62 72.52 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.559 -0.746 . . . . 70.02 111.482 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -52.2 -44.01 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.207 -0.451 . . . . 65.55 111.295 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 38.8 mt-10 -67.55 -51.14 54.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.9 -0.591 . . . . 72.14 110.694 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.1 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.02 -0.536 . . . . 53.13 111.145 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.0 tp -61.93 -44.3 97.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 75.05 110.722 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -70.27 -33.82 72.04 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.416 -0.356 . . . . 71.15 111.097 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.6 mt -62.3 -48.35 80.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.988 -0.375 . . . . 72.21 109.988 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.445 HG21 HG12 ' A' ' 112' ' ' ILE . 29.6 mm -54.08 -60.49 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-N 115.772 -0.649 . . . . 73.23 111.302 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -63.8 -28.91 70.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 74.21 111.0 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -64.43 -54.72 27.58 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 111.609 -0.597 . . . . 70.22 111.609 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.463 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.3 m-85 -56.73 -45.15 82.13 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.005 -0.368 . . . . 72.23 110.005 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.456 ' CD1' ' HA2' ' A' ' 102' ' ' GLY . 78.6 mt -54.98 -47.76 76.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.798 -0.637 . . . . 72.34 110.843 178.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -64.61 -40.13 94.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 63.41 110.756 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.3 mtpp -64.39 -39.83 94.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.96 0.409 . . . . 74.2 110.692 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 46' ' ' TYR . 88.4 mt -68.87 -46.91 78.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.637 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -62.17 -29.08 70.11 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.307 -0.406 . . . . 72.54 112.04 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 m -77.41 -9.04 58.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.828 0.347 . . . . 72.12 110.76 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 3.33 83.35 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.002 -0.618 . . . . 75.33 112.288 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -73.78 -62.54 1.46 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.992 0.425 . . . . 63.43 110.783 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -101.92 167.15 10.24 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.066 -0.516 . . . . 72.11 110.682 -178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -119.66 140.41 50.67 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.531 -0.544 . . . . 53.51 109.531 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -57.32 -55.6 32.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.8 0.296 . . . . 75.02 111.8 -177.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -53.14 -42.52 66.16 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.686 0.279 . . . . 75.31 111.351 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.6 m -64.39 -47.28 79.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.294 -0.412 . . . . 72.35 110.93 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.89 -43.29 79.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 74.12 111.016 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.611 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -68.53 -10.85 58.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.142 -0.481 . . . . 75.22 112.273 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 70.5 m -88.38 -13.19 41.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.775 0.322 . . . . 75.45 111.267 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -128.62 -36.41 1.85 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.7 0.63 . . . . 64.52 112.7 -177.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.81 9.1 38.59 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.4 0.518 . . . . 74.52 112.4 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -92.09 114.45 26.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.708 -0.397 . . . . 72.05 110.06 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.441 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 59.5 m-20 -78.76 51.3 1.08 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.256 0.55 . . . . 61.35 110.781 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.479 ' HB2' HD22 ' A' ' 15' ' ' LEU . 26.0 t -164.61 178.19 7.51 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.676 -0.693 . . . . 71.24 109.355 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -67.06 -14.06 62.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.97 0.414 . . . . 51.43 110.713 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.5 m -56.11 -24.77 42.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.738 -0.665 . . . . 75.01 111.024 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.611 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -61.11 -30.29 70.27 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.923 -0.58 . . . . 62.35 111.725 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -83.44 -11.46 57.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.063 0.459 . . . . 71.11 111.043 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.48 13.81 18.94 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.205 -0.452 . . . . 70.44 111.248 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 64.03 11.19 5.94 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.305 -0.407 . . . . 75.24 111.724 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.402 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.39 -25.08 3.35 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 121.053 -0.594 . . . . 62.45 112.606 -178.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -77.91 126.61 31.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.063 0.459 . . . . 75.22 111.421 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -103.42 -4.75 23.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.726 -0.67 . . . . 74.4 110.776 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.426 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 78.13 -165.32 51.96 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.194 -1.003 . . . . 70.35 110.924 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.22 119.26 22.75 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.877 -0.416 . . . . 72.31 109.877 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.466 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 29.4 p90 -127.4 162.7 25.7 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.229 -0.442 . . . . 72.52 110.83 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.9 t -82.94 135.63 34.83 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.93 -0.577 . . . . 73.31 109.816 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -57.35 -31.49 65.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.898 -0.592 . . . . 74.02 111.939 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.82 73.1 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.662 -0.78 . . . . 53.05 112.222 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.6 16.37 17.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.957 0.408 . . . . 71.54 109.966 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.2 tpp -130.39 154.18 47.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.04 -0.527 . . . . 73.43 110.635 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -60.46 144.26 51.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.529 -0.305 . . . . 62.32 110.566 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.472 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 48.2 tptt -59.46 -50.4 87.43 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 113.093 0.775 . . . . 74.55 113.093 -176.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 16.9 Cg_endo -58.76 -35.43 98.64 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 121.79 1.66 . . . . 75.21 111.445 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -68.57 -44.37 74.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.582 -0.736 . . . . 73.43 109.174 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.46 -48.59 80.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.605 -0.725 . . . . 71.4 110.158 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -55.58 -42.77 75.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.503 -0.771 . . . . 63.04 111.4 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.432 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -70.99 -40.7 71.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.327 -0.397 . . . . 71.15 110.91 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.468 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 52.9 m -62.87 -45.22 93.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.039 0.447 . . . . 73.43 111.328 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -78.65 -6.24 55.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.098 -0.501 . . . . 74.51 111.587 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.67 -26.3 21.92 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.252 -0.647 . . . . 74.32 109.252 175.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.0 mt -86.43 179.71 6.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.195 -0.911 . . . . 73.33 110.787 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -130.21 176.65 7.93 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.548 -0.751 . . . . 74.24 109.542 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.4 m -61.05 110.16 1.28 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.012 0.434 . . . . 64.45 111.035 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.39 16.22 32.74 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 121.023 -0.608 . . . . 55.41 112.502 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -109.72 148.17 31.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.849 0.357 . . . . 72.44 111.237 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' MET . . . . . 0.438 ' HE2' HG21 ' A' ' 47' ' ' ILE . 40.3 ttp -128.63 127.96 43.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.027 -0.533 . . . . 65.04 110.473 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.417 ' HB2' HD13 ' A' ' 95' ' ' LEU . 32.1 t -83.05 161.42 21.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.031 -0.531 . . . . 63.25 110.823 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.456 ' HA2' ' CD1' ' A' ' 47' ' ' ILE . . . -84.98 -139.02 4.47 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 115.938 -0.574 . . . . 44.23 112.405 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.58 106.15 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.821 2.347 . . . . 72.11 112.665 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.96 123.24 67.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.483 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -97.12 124.75 41.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.2 -0.455 . . . . 73.34 109.872 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.2 p -113.5 -60.56 1.87 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.364 0.505 . . . . 61.45 112.364 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -144.57 -53.01 0.31 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.382 0.512 . . . . 71.31 112.382 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 m -113.53 -53.67 2.67 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.944 0.35 . . . . 74.23 111.944 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.38 -169.38 12.61 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 119.973 -1.108 . . . . 63.05 112.733 -177.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.7 mt -90.78 138.49 19.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.501 -0.555 . . . . 73.13 109.501 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 72.9 m-70 -119.89 145.31 46.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.765 0.317 . . . . 73.01 111.373 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 50.0 mt -100.95 117.35 46.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.469 -1.308 . . . . 74.11 107.469 173.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 62.6 mt -103.72 110.9 31.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 120.92 0.39 . . . . 73.51 111.724 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.8 tp -106.09 107.4 18.38 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.815 -0.63 . . . . 72.43 109.842 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -85.19 100.22 11.61 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.686 -0.487 . . . . 74.13 109.686 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.2 m -74.15 -38.18 63.8 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.686 -0.688 . . . . 74.24 110.56 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.257 1.447 0 CA-C-O 118.518 -0.753 . . . . 73.21 110.318 -178.714 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 121.17 0.51 . . . . 63.34 110.214 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -113.24 127.04 56.04 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.602 -0.727 . . . . 72.02 109.784 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.1 m -125.58 143.65 38.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 CA-C-N 116.263 -0.426 . . . . 72.34 110.514 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -112.27 122.92 49.08 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.623 -0.51 . . . . 74.13 109.623 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.501 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 69.5 m -134.53 167.64 20.42 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.101 0.476 . . . . 52.53 111.049 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -122.37 145.33 48.37 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.486 -0.931 . . . . 73.32 108.486 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.427 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.6 p80 -124.06 129.44 50.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.448 -0.501 . . . . 74.14 112.304 -176.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.485 ' CD1' ' HA ' ' A' ' 61' ' ' ALA . 38.4 tp -106.2 119.11 38.37 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 108.506 -0.924 . . . . 74.22 108.506 176.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.61 HD11 ' NE2' ' A' ' 111' ' ' HIS . 13.8 tp -116.84 120.17 37.68 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.15 0.5 . . . . 63.02 111.326 -178.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.7 t -118.47 105.92 18.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.0 -1.0 . . . . 74.14 108.312 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -76.48 168.85 19.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.497 0.665 . . . . 73.2 111.803 -177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.427 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 2.0 p80 -139.26 156.26 47.19 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.134 -0.939 . . . . 72.4 109.828 -178.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 21' ' ' SER . 8.7 p -51.34 -38.02 50.93 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 123.834 0.709 . . . . 72.32 112.059 -178.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -74.05 29.96 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.659 0.614 . . . . 73.41 112.659 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.418 ' H ' ' C ' ' A' ' 19' ' ' SER . 22.4 t -113.16 179.42 3.97 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.972 -0.751 . . . . 75.32 108.972 177.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.41 HH12 ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -83.27 -29.4 28.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.933 0.397 . . . . 71.34 110.364 -179.733 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -111.19 102.0 51.79 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.098 -0.501 . . . . 74.21 110.43 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.44 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 66.1 Cg_endo -92.03 34.26 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.998 2.465 . . . . 74.13 111.712 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.5 p -149.76 158.07 43.82 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.925 0.393 . . . . 74.43 111.054 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.9 p -148.27 -161.6 1.37 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 72.41 109.667 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 70.2 p-90 -89.76 -5.58 56.82 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.916 0.389 . . . . 75.21 110.584 178.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -130.71 0.13 4.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.255 -0.43 . . . . 63.33 111.73 -177.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -148.36 128.72 13.88 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.697 -0.483 . . . . 70.43 109.697 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.7 -31.34 32.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.495 -0.321 . . . . 75.14 111.068 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 20.9 ptmt -140.57 106.93 5.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.391 0.615 . . . . 73.55 111.551 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.6 mm -67.79 102.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.825 -0.805 . . . . 63.05 108.825 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 m -97.68 -11.44 23.5 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.92 -0.582 . . . . 70.24 110.674 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -74.7 129.41 37.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.021 -0.536 . . . . 74.1 110.287 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.468 HG23 ' OE1' ' A' ' 38' ' ' GLU . 9.0 t -87.24 -178.66 6.26 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 120.759 -0.376 . . . . 62.34 110.027 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -62.87 -44.46 96.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.841 -0.163 . . . . 61.32 111.426 -177.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.7 mp0 -57.04 -44.18 82.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.416 -0.356 . . . . 72.12 110.567 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.468 ' OE1' HG23 ' A' ' 35' ' ' THR . 42.1 mt-10 -66.97 -43.87 81.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.847 -0.615 . . . . 55.34 110.727 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.554 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.49 -41.21 98.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.015 -0.539 . . . . 74.12 110.584 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.86 -42.1 92.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.903 -0.59 . . . . 75.21 110.05 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 50.3 mm-40 -58.39 -41.57 85.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 73.13 110.474 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.04 -40.73 87.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.856 -0.611 . . . . 52.12 110.036 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.5 mm -53.55 -49.47 55.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.674 -0.694 . . . . 61.11 111.066 179.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -55.23 -47.07 75.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.162 0.506 . . . . 73.33 110.191 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -57.33 -47.29 89.04 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.437 -0.801 . . . . 51.23 112.257 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.468 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.3 m-85 -59.94 -52.3 66.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.347 0.118 . . . . 74.1 110.948 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -56.22 -45.95 81.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.023 0.439 . . . . 75.32 110.705 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -66.21 -42.01 89.35 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.887 -0.597 . . . . 75.41 112.142 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 30.0 mtpp -63.58 -37.98 89.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.621 0.248 . . . . 64.15 111.491 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 46' ' ' TYR . 79.0 mt -66.33 -48.16 81.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.39 -0.368 . . . . 55.43 110.718 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -69.98 -18.49 63.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.345 -0.389 . . . . 63.5 111.924 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -91.12 1.05 57.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.912 0.387 . . . . 71.23 110.741 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.08 30.27 69.98 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.999 -0.546 . . . . 75.12 113.363 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -92.11 -53.13 4.38 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.506 -0.408 . . . . 72.32 110.655 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -137.1 148.02 46.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.08 -0.509 . . . . 74.21 110.077 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -81.89 160.82 23.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.093 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -62.81 -53.9 47.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.935 -0.575 . . . . 75.03 110.582 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.471 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 2.8 mp0 -58.45 -31.24 67.6 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 72.13 110.509 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 29.7 t -67.23 -52.07 45.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.758 -0.656 . . . . 73.4 109.652 178.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.24 -33.88 76.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.398 -0.365 . . . . 73.41 110.858 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.485 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -63.89 -32.44 73.96 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.033 -0.53 . . . . 75.03 111.46 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -95.76 5.72 50.68 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.987 0.423 . . . . 75.53 111.225 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 59' ' ' SER . 27.8 mt-30 -115.43 -53.96 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.193 0.442 . . . . 64.13 112.193 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -108.88 -6.76 15.64 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.661 0.986 . . . . 43.54 113.661 -173.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -78.83 136.92 37.47 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.022 -0.671 . . . . 62.55 110.599 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -95.63 11.61 32.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.847 -0.615 . . . . 75.33 110.367 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.507 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 48.3 t -81.81 145.2 30.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.699 -0.682 . . . . 63.44 110.146 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 p -62.4 -26.3 68.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.073 0.463 . . . . 71.0 110.983 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 m -74.94 -4.99 41.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.73 -0.668 . . . . 65.45 111.81 -178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.06 65.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.815 0.34 . . . . 71.43 111.187 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -32.63 74.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.231 0.539 . . . . 74.33 110.624 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.33 16.36 11.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.849 -0.614 . . . . 73.42 110.19 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 12.3 mpt_? 67.45 14.16 9.54 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.402 -0.817 . . . . 73.35 111.94 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.427 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.35 7.65 88.34 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.738 -0.744 . . . . 44.02 112.806 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -80.02 136.95 36.7 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.828 0.347 . . . . 61.23 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 mp -101.49 -21.2 14.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.161 -0.472 . . . . 43.2 110.109 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.96 -171.04 42.3 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.772 -0.931 . . . . 42.01 110.772 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.05 107.93 10.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 117.187 0.494 . . . . 64.24 110.182 179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.0 p90 -123.59 -174.37 2.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.192 -0.458 . . . . 74.55 110.756 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -148.87 -165.89 2.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.247 -0.649 . . . . 72.01 109.247 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -66.63 134.43 52.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.033 0.444 . . . . 73.53 111.769 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.451 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 102.91 22.91 8.97 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.878 -0.601 . . . . 61.34 112.375 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -122.99 -34.81 3.11 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.33 0.493 . . . . 54.51 112.33 -177.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.1 tpp -135.73 171.33 14.61 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.812 -0.355 . . . . 60.44 111.207 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -55.58 141.61 36.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.315 -0.402 . . . . 72.42 110.273 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.96 -48.57 87.76 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.195 0.813 . . . . 71.02 113.195 -176.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.51 -28.79 29.53 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.209 1.939 . . . . 71.44 113.03 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.505 ' CD2' HG12 ' A' ' 113' ' ' ILE . 48.1 t80 -95.48 -49.88 5.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.324 0.583 . . . . 74.45 110.387 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 34.7 tt0 -61.21 -50.22 73.96 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.324 -0.853 . . . . 63.13 111.557 -176.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.48 -39.64 95.0 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.899 0.381 . . . . 65.1 111.05 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.61 -32.26 73.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.863 -0.608 . . . . 64.43 111.231 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.501 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 67.5 m -60.19 -31.77 70.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.177 -0.465 . . . . 72.31 111.294 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -86.81 -19.49 28.93 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.26 -0.427 . . . . 74.22 110.526 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.93 -42.93 15.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 74.13 111.395 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 69.8 mt -81.79 145.08 30.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.058 -0.519 . . . . 74.25 110.334 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . 0.488 ' CG ' ' HG2' ' A' ' 99' ' ' GLU . 28.7 ptt180 -80.66 176.9 9.39 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.814 -0.439 . . . . 74.44 109.814 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -66.71 114.43 5.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.131 -0.486 . . . . 62.21 110.821 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.39 6.8 38.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.504 -0.855 . . . . 61.11 113.814 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.488 ' HG2' ' CG ' ' A' ' 96' ' ' ARG . 63.1 mm-40 -88.32 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.387 0.594 . . . . 73.13 111.905 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.9 tpp -104.44 128.47 52.34 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.163 -0.926 . . . . 74.01 109.261 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.415 ' CB ' ' HB ' ' A' ' 113' ' ' ILE . 32.8 t -91.74 156.37 17.61 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 116.454 -0.339 . . . . 75.32 110.223 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.65 -168.2 38.46 Favored Glycine 0 N--CA 1.44 -1.059 0 C-N-CA 120.754 -0.736 . . . . 41.43 111.525 178.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -66.13 102.46 0.56 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.78 2.32 . . . . 75.31 112.35 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.3 110.95 24.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 61.35 109.675 178.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -78.08 110.87 13.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.018 -0.537 . . . . 72.55 111.004 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 m -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.891 -0.781 . . . . 74.13 108.891 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.41 ' HB2' HH12 ' A' ' 22' ' ' ARG . 7.1 p-10 -60.1 -32.63 71.16 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.082 0.401 . . . . 74.31 112.082 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 p -79.36 -35.58 40.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.1 0.476 . . . . 54.22 111.602 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . 0.427 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . 167.97 -162.88 36.68 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 110.863 -0.895 . . . . 72.4 110.863 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.8 mt -87.64 131.75 34.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 109.782 -0.451 . . . . 74.21 109.782 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.61 ' NE2' HD11 ' A' ' 15' ' ' LEU . 14.3 m-70 -121.47 139.65 53.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.282 -0.417 . . . . 74.31 111.163 -178.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.411 HD13 HD22 ' A' ' 14' ' ' LEU . 21.9 mt -109.34 139.5 31.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.15 -1.056 . . . . 74.12 108.15 173.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.505 HG12 ' CD2' ' A' ' 88' ' ' PHE . 23.5 mt -114.68 129.55 70.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 120.744 0.306 . . . . 53.31 111.606 -175.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -133.2 119.58 20.05 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.484 -0.561 . . . . 63.1 109.484 174.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -84.2 108.26 16.99 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.99 0.424 . . . . 65.22 109.938 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 m -70.18 -51.96 27.09 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.626 -0.715 . . . . 62.12 110.241 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.39 -0.814 . . . . 75.44 109.51 179.685 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.885 0.374 . . . . 62.45 110.625 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -109.97 96.12 6.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.453 -0.573 . . . . 73.0 109.453 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.2 p -109.92 145.33 16.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 116.205 -0.452 . . . . 51.31 110.793 -177.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -109.74 120.44 42.49 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.237 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -134.3 154.47 51.3 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.946 -0.57 . . . . 75.24 110.403 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 m -98.37 149.26 22.83 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.255 -1.017 . . . . 63.53 108.255 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -148.06 136.96 21.89 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.283 0.564 . . . . 74.21 112.51 -176.677 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.551 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.5 tt -106.98 140.77 39.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.271 -0.877 . . . . 70.42 108.817 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -132.91 127.08 33.54 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 110.054 -0.35 . . . . 75.24 110.054 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -122.27 127.83 75.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.018 0.437 . . . . 71.41 110.173 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -91.82 171.8 8.9 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.236 0.541 . . . . 52.41 111.032 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -152.37 163.03 40.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.87 -0.604 . . . . 73.13 109.848 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.8 t -54.64 -41.63 70.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.253 0.549 . . . . 74.35 110.189 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.01 62.31 6.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.873 -0.603 . . . . 74.1 110.113 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.0 t -135.17 165.17 26.01 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.458 -0.571 . . . . 62.41 109.458 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 73.7 mtm180 -63.2 -34.31 77.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.225 0.536 . . . . 73.51 110.116 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -129.98 89.49 45.5 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 115.917 -0.583 . . . . 74.52 110.47 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.43 72.63 5.9 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.657 2.238 . . . . 53.31 111.167 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -157.36 143.4 17.7 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.964 -0.562 . . . . 60.23 109.941 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.4 p -144.84 172.58 12.82 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.684 0.278 . . . . 72.5 110.551 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -88.68 -5.19 58.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.412 0.625 . . . . 75.0 109.434 177.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 43.0 mtp180 -98.63 -48.36 5.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.097 -0.956 . . . . 75.24 111.087 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -114.63 146.93 40.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.152 -0.477 . . . . 73.35 110.56 -175.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -83.58 -47.22 11.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 74.55 110.25 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -121.42 116.96 25.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.381 -0.6 . . . . 51.34 109.381 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.6 mm -75.98 94.02 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.176 -0.465 . . . . 72.24 111.442 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 m -87.54 -25.59 23.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.279 0.562 . . . . 73.32 110.096 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.417 ' HA ' ' OE2' ' A' ' 38' ' ' GLU . 9.1 ptt180 -60.43 119.47 8.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.362 -0.836 . . . . 73.33 111.834 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -80.72 -178.14 6.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.878 -0.601 . . . . 73.25 110.644 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.16 -35.19 79.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.466 -0.334 . . . . 75.12 110.504 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -64.01 -43.16 96.47 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.3 -0.409 . . . . 62.31 110.976 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.51 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 42.4 mt-10 -62.7 -41.37 99.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 74.22 110.653 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.488 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.11 -40.3 97.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.134 -0.484 . . . . 63.22 110.21 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.67 -42.46 91.3 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.7 -0.682 . . . . 64.03 109.974 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -59.54 -42.08 91.5 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.276 -0.42 . . . . 75.23 110.595 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.8 mt -62.04 -45.85 91.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.973 -0.558 . . . . 75.3 110.419 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 39' ' ' ALA . 42.9 mm -55.99 -53.15 41.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.155 -0.475 . . . . 74.04 110.817 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.45 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 88.5 m-20 -59.49 -43.7 93.26 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.471 -0.332 . . . . 74.45 110.592 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.42 -49.94 71.64 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.963 -0.562 . . . . 65.13 112.096 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.2 m-85 -61.04 -51.96 66.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.327 0.108 . . . . 75.14 110.784 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 69.7 mt -54.75 -43.29 66.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.829 0.347 . . . . 71.14 111.117 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 14.6 mm100 -63.81 -45.58 88.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.398 -0.365 . . . . 55.14 111.141 178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -69.01 -36.26 77.6 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 111.842 0.312 . . . . 64.23 111.842 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 46' ' ' TYR . 83.9 mt -61.42 -49.74 83.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.291 . . . . 64.2 110.744 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -64.66 -34.94 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.22 111.472 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.8 m -65.51 -31.29 72.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.304 -0.407 . . . . 72.0 111.497 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.91 25.65 6.72 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.562 -0.827 . . . . 63.15 111.826 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -89.24 -75.41 0.44 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.118 0.485 . . . . 40.45 110.207 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 8.7 mm-40 -109.67 146.3 35.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.66 -0.7 . . . . 70.31 109.545 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -88.71 159.53 17.76 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 109.643 -0.503 . . . . 74.35 109.643 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -53.59 -42.01 67.17 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.639 0.257 . . . . 71.51 111.126 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.49 -12.74 61.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.386 -0.37 . . . . 74.51 111.559 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -80.01 -29.75 39.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.056 0.455 . . . . 45.13 110.313 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.2 -45.86 7.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.42 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.99 67.27 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.734 0.642 . . . . 72.43 112.734 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.622 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 15.0 m -88.91 -3.25 58.79 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.312 0.486 . . . . 64.54 112.312 -177.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -133.5 -47.32 0.82 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.341 0.497 . . . . 73.24 112.341 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -99.25 23.79 8.76 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.132 0.419 . . . . 75.14 112.132 -174.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -112.47 127.63 56.1 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.083 0.468 . . . . 74.31 110.375 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.482 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 8.2 m-20 -90.24 65.97 6.48 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.023 -0.535 . . . . 73.13 110.252 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.2 p -155.87 169.17 25.04 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.134 -0.485 . . . . 71.35 110.173 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.8 m -69.71 -23.71 63.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.008 0.433 . . . . 74.12 110.588 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.1 m -67.27 -15.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.901 -0.591 . . . . 71.25 111.73 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.34 -30.13 70.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.193 0.52 . . . . 71.22 110.605 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -84.09 -7.95 59.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.925 -0.579 . . . . 72.44 109.974 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.41 21.72 16.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.583 -0.735 . . . . 65.54 110.841 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.622 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 26.9 mtp180 69.45 12.93 8.36 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.996 -0.547 . . . . 74.03 111.699 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.43 -10.31 73.82 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.211 -0.755 . . . . 71.05 111.211 -177.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -71.58 129.33 38.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.815 0.34 . . . . 54.02 110.745 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.468 HD22 ' O ' ' A' ' 76' ' ' LEU . 4.8 tt -89.07 -35.47 16.31 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.166 -0.679 . . . . 74.44 109.166 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.77 -178.02 33.37 Favored Glycine 0 N--CA 1.432 -1.595 0 N-CA-C 110.449 -1.061 . . . . 61.34 110.449 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 112.97 11.87 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.925 0.362 . . . . 63.23 110.132 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -116.03 151.57 35.23 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.814 0.34 . . . . 71.22 111.301 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -169.53 -169.62 0.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.267 -0.642 . . . . 62.54 109.267 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 63.16 18.77 11.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.215 0.606 . . . . 74.44 112.521 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 66.0 33.75 86.43 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.863 -0.684 . . . . 72.51 112.736 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -83.24 -14.26 53.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.894 0.378 . . . . 71.42 111.027 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.5 tpp -115.64 154.27 29.78 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.991 -0.55 . . . . 73.54 109.586 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -51.45 134.49 28.73 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.466 0.479 . . . . 64.31 111.674 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.7 tptt -56.61 -47.78 98.37 Favored Pre-proline 0 CA--C 1.548 0.88 0 N-CA-C 112.809 0.67 . . . . 60.04 112.809 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.1 Cg_endo -54.74 -25.18 41.19 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.257 1.972 . . . . 74.43 111.979 177.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CE2' HG12 ' A' ' 113' ' ' ILE . 41.3 t80 -85.84 -43.47 13.26 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.71 -0.677 . . . . 74.31 109.33 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.6 -51.64 68.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.383 -0.826 . . . . 73.45 111.31 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . 0.458 ' OD2' ' HE3' ' A' ' 86' ' ' LYS . 8.8 m-20 -54.5 -46.57 73.49 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.535 -0.302 . . . . 71.4 111.078 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.653 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -64.68 -42.24 95.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.806 -0.634 . . . . 74.35 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -65.68 -45.2 83.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.83 0.348 . . . . 71.34 111.269 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -65.73 -24.83 67.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.158 -0.474 . . . . 73.35 111.314 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.76 -5.38 59.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.283 -0.417 . . . . 41.31 111.574 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 96.6 mt -96.69 143.68 27.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.706 0.289 . . . . 72.44 110.389 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -92.17 -179.73 5.33 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.345 -0.389 . . . . 72.42 110.245 176.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.3 m -64.79 125.12 23.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.944 -0.571 . . . . 75.32 110.324 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.29 21.55 64.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.901 -0.666 . . . . 62.33 111.999 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -111.81 143.91 41.98 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.037 0.446 . . . . 72.11 110.917 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -124.79 134.83 52.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.449 -0.796 . . . . 71.43 109.773 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -80.11 -69.0 0.62 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.009 0.433 . . . . 74.11 111.02 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.41 ' O ' ' HA ' ' A' ' 112' ' ' ILE . . . 139.69 -142.82 13.07 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 111.188 -0.765 . . . . 72.11 111.188 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -76.45 98.37 1.2 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.552 2.168 . . . . 75.24 112.933 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -95.08 110.95 24.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.237 -0.653 . . . . 73.01 109.237 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -82.51 122.94 28.7 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.126 -0.488 . . . . 75.02 111.834 -177.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.0 p -136.74 174.39 10.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.61 -0.723 . . . . 63.12 109.669 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -62.99 -31.2 72.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.932 0.396 . . . . 73.14 110.961 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.4 p -79.76 -5.65 55.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 71.51 111.793 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 123.1 -156.72 17.52 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.687 -0.768 . . . . 63.3 111.886 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 48.4 mt -97.62 126.97 50.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.588 0.233 . . . . 75.23 110.387 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . 0.551 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 93.1 m-70 -114.34 135.44 54.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.517 -0.311 . . . . 75.34 111.204 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 45.3 mt -105.75 125.37 61.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 107.915 -1.143 . . . . 71.5 107.915 173.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ILE . . . . . 0.471 HG12 ' CE2' ' A' ' 88' ' ' PHE . 32.0 mt -107.71 128.96 62.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.791 0.329 . . . . 65.31 111.779 -176.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.5 tp -131.44 108.88 9.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.771 -0.649 . . . . 71.33 109.589 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -81.43 120.84 25.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.74 0.305 . . . . 75.32 110.68 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 p -100.05 -29.21 12.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.335 -0.393 . . . . 64.3 111.278 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.485 -0.769 . . . . 61.32 110.697 179.814 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.159 0 N-CA-C 111.749 -0.54 . . . . 22.43 111.749 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.8 m -81.63 107.67 14.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.019 0.438 . . . . 73.51 110.387 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -99.23 6.81 46.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 72.21 111.279 -177.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.2 ptm -150.14 148.02 28.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.467 -0.333 . . . . 73.41 110.92 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -111.28 104.49 56.21 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.938 -0.574 . . . . 65.41 109.745 178.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -88.34 137.98 3.81 Favored 'Trans proline' 0 N--CA 1.443 -1.469 0 C-N-CA 122.386 2.057 . . . . 75.2 111.912 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.59 -14.06 35.83 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.287 0.565 . . . . 61.33 109.653 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 8' ' ' ARG . 59.8 mtt85 -127.28 117.17 21.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.345 -0.843 . . . . 73.52 109.788 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.52 137.08 57.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-N 116.327 -0.397 . . . . 72.11 110.378 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.419 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 36.6 ttt180 -112.31 125.84 54.62 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.464 -0.334 . . . . 75.52 110.183 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -143.23 139.18 30.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.0 0.429 . . . . 51.01 111.204 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.432 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 15.4 m -98.29 153.87 18.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.428 -0.953 . . . . 41.51 108.428 176.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 145.83 37.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.406 0.891 . . . . 71.12 113.406 -175.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.43 ' HG ' ' HB2' ' A' ' 65' ' ' SER . 10.4 tt -122.59 141.01 52.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.945 -1.025 . . . . 73.25 108.322 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.577 HD22 ' CD2' ' A' ' 111' ' ' HIS . 2.7 tm? -139.17 131.05 27.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.93 0.395 . . . . 70.42 110.944 -178.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.404 ' N ' HD23 ' A' ' 15' ' ' LEU . 73.4 t -123.63 126.17 72.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.786 -0.82 . . . . 75.2 108.786 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HE3' ' O ' ' A' ' 25' ' ' SER . 60.8 mttm -71.74 171.48 11.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.063 0.459 . . . . 63.34 111.236 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -142.31 168.72 19.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.805 -0.634 . . . . 64.43 110.117 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.6 m -56.59 -34.63 67.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.896 0.702 . . . . 75.25 112.896 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -89.84 12.64 16.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.416 0.524 . . . . 75.52 112.416 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.5 m -74.59 154.17 38.68 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 110.335 -0.246 . . . . 62.32 110.335 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.15 -42.24 99.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.962 0.411 . . . . 61.14 111.111 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -106.41 104.7 51.61 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 109.51 -0.552 . . . . 74.42 109.51 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.482 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 86.6 Cg_endo -82.93 22.39 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.886 2.391 . . . . 73.32 112.36 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.418 ' O ' ' HE3' ' A' ' 17' ' ' LYS . 25.8 p -144.44 155.72 43.87 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.699 -0.482 . . . . 72.32 109.699 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.9 p -136.27 -165.94 1.8 Allowed 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.773 0.32 . . . . 65.43 110.276 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -92.66 8.4 39.3 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.343 0.592 . . . . 71.35 109.868 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -134.35 -32.03 1.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.566 -0.743 . . . . 75.4 111.481 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -116.6 148.19 41.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.855 -0.424 . . . . 52.23 109.855 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -85.15 -39.81 17.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 64.31 110.74 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 25.4 pttm -143.77 134.93 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.925 -0.579 . . . . 75.11 110.527 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mm -88.63 94.08 4.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.176 -0.466 . . . . 74.22 110.143 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 m -82.54 -22.72 34.87 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.717 -0.674 . . . . 70.33 110.653 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -73.05 134.77 44.71 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.172 -0.467 . . . . 61.31 111.003 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.9 t -92.5 -171.16 2.69 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.311 -0.404 . . . . 73.21 110.23 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -52.15 -53.87 37.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.164 0.585 . . . . 62.13 111.783 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 13.7 mm-40 -64.39 -39.99 94.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.174 -0.466 . . . . 73.33 112.221 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.82 -37.9 87.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.897 0.379 . . . . 74.12 110.91 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.428 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -72.59 -35.79 67.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.107 0.48 . . . . 52.33 109.975 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 40.1 tp -62.55 -37.5 86.38 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.531 -0.759 . . . . 64.42 111.059 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 48.4 mt-10 -60.99 -42.42 98.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.106 178.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.3 -45.71 90.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.029 -0.532 . . . . 74.11 109.984 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.1 mm -54.45 -53.2 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.766 -0.652 . . . . 75.34 110.645 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -62.04 -35.33 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.049 -0.523 . . . . 73.44 110.99 179.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -61.33 -48.98 82.33 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.565 -0.614 . . . . 71.3 111.565 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 50' ' ' ILE . 15.8 m-85 -56.61 -51.42 68.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.869 0.366 . . . . 72.14 110.113 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 78.3 mt -55.89 -48.8 77.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 115.515 -0.766 . . . . 65.31 111.316 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.78 -42.11 92.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.286 -0.416 . . . . 73.42 111.493 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 45.1 mtpt -62.97 -42.26 99.78 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.794 0.33 . . . . 73.44 111.113 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.456 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 78.9 mt -64.98 -47.94 86.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.141 -0.481 . . . . 75.51 111.024 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -64.17 -32.93 74.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.722 0.296 . . . . 74.11 111.566 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.8 m -76.23 -28.37 57.15 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.801 0.334 . . . . 74.2 111.312 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.35 13.37 28.71 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.397 -0.906 . . . . 74.32 111.933 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.64 -46.49 63.19 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.531 -0.544 . . . . 64.52 109.531 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 36.7 mt-10 -145.28 177.38 8.85 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.576 -0.738 . . . . 74.51 109.807 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -118.55 157.31 27.57 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.01 -0.737 . . . . 72.33 109.01 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -55.16 -24.74 28.13 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.331 0.493 . . . . 52.42 112.331 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -55.21 -51.0 67.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.922 0.341 . . . . 73.42 111.922 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.0 p -70.51 -39.71 73.93 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 120.906 0.384 . . . . 63.21 110.992 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.402 HD12 ' CD1' ' A' ' 46' ' ' TYR . 3.6 mm? -64.15 -46.94 81.83 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.982 -0.553 . . . . 73.22 111.336 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.95 -10.37 59.73 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.256 0.465 . . . . 74.43 112.256 -178.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.611 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 40.5 m -101.49 -52.25 3.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 70.2 111.793 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -102.62 -2.57 28.12 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.01 0.744 . . . . 70.14 113.01 -174.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -128.69 16.68 6.39 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 120.827 0.346 . . . . 75.33 111.05 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.43 ' HB2' ' HG ' ' A' ' 14' ' ' LEU . 23.3 t -125.27 149.89 47.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 73.4 111.063 -178.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -92.0 -14.96 28.59 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.581 -0.736 . . . . 74.32 110.306 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.409 ' HG ' ' HB3' ' A' ' 15' ' ' LEU . 51.1 m -55.3 134.1 49.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.751 -0.659 . . . . 75.32 111.241 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.6 m -60.02 -25.83 65.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 74.4 110.808 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 m -68.64 -6.8 28.0 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.077 -0.511 . . . . 70.23 111.602 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.73 -29.1 58.93 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.669 0.387 . . . . 62.33 111.704 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -71.43 -17.32 62.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.05 0.453 . . . . 74.51 110.898 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.426 ' O ' ' HB2' ' A' ' 73' ' ' ARG . . . -114.16 30.03 7.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.84 -0.618 . . . . 52.21 109.922 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.611 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 86.8 mtm180 74.37 10.87 4.2 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.549 -0.751 . . . . 75.05 112.406 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.17 2.51 85.68 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.843 -0.694 . . . . 62.45 113.126 177.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.432 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 30.4 t70 -85.23 140.72 30.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.903 0.382 . . . . 74.51 111.247 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.5 mt -94.01 -12.2 29.16 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 75.22 110.645 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.419 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 81.09 -166.32 48.22 Favored Glycine 0 N--CA 1.436 -1.351 0 N-CA-C 111.169 -0.773 . . . . 52.31 111.169 -177.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.84 109.11 17.86 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.935 0.398 . . . . 72.13 110.412 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.9 p90 -115.93 176.45 5.08 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 116.211 -0.449 . . . . 74.21 110.21 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.5 t -121.54 -172.13 2.36 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 110.05 -0.352 . . . . 74.54 110.05 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -73.8 149.33 41.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.205 -0.452 . . . . 62.41 110.255 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.96 36.19 57.46 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.792 -0.718 . . . . 23.51 111.745 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -126.8 -22.91 3.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.663 0.268 . . . . 64.12 111.534 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.412 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 46.8 tpp -131.63 164.54 25.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.736 -0.211 . . . . 74.44 110.902 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -52.32 139.63 23.83 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.585 -0.279 . . . . 44.52 110.44 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.458 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 55.8 tptt -51.57 -51.45 69.46 Favored Pre-proline 0 CA--C 1.551 1.004 0 N-CA-C 113.408 0.892 . . . . 73.41 113.408 -176.142 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.458 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.7 Cg_exo -56.32 -28.62 72.97 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.073 1.848 . . . . 63.12 112.741 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.58 ' CE2' HG12 ' A' ' 113' ' ' ILE . 21.4 t80 -90.25 -52.33 4.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.161 -0.472 . . . . 75.33 110.346 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.27 -49.84 76.02 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.736 -0.665 . . . . 72.52 111.439 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.75 -32.7 74.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 73.31 110.725 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.636 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.34 -37.16 71.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.042 -0.526 . . . . 72.54 110.142 178.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.439 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 40.3 m -59.01 -45.19 91.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.276 -0.42 . . . . 73.22 110.595 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -69.82 -28.31 65.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.394 -0.366 . . . . 65.41 111.026 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.81 -30.91 59.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 62.45 111.073 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 89.8 mt -72.2 168.03 19.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.19 -0.459 . . . . 74.43 110.466 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -104.06 173.52 6.27 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.313 -0.403 . . . . 73.32 109.972 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.1 m -69.51 116.21 9.66 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.879 -0.415 . . . . 55.4 109.879 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.51 45.96 5.36 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.888 -0.885 . . . . 51.15 110.888 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.41 130.86 52.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.698 0.285 . . . . 73.32 110.768 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.2 ttp -109.3 108.28 18.81 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.114 -0.494 . . . . 71.34 109.754 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.7 t -73.25 155.9 39.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.777 -0.647 . . . . 62.03 110.653 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.42 -154.64 15.03 Favored Glycine 0 N--CA 1.435 -1.41 0 CA-C-N 115.775 -0.648 . . . . 53.24 112.231 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.79 104.57 0.69 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.054 2.503 . . . . 71.44 113.053 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.9 t -101.78 117.65 47.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 51.2 109.688 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.13 124.14 28.99 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.902 0.382 . . . . 72.45 110.996 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.534 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -135.0 -173.72 3.39 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 116.193 -0.458 . . . . 75.33 109.927 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.534 ' H ' HG22 ' A' ' 106' ' ' THR . 4.6 m-20 -49.61 -61.9 1.85 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.713 0.805 . . . . 72.45 112.699 -177.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.5 p -64.8 -37.23 86.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.459 0.54 . . . . 74.5 112.459 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 163.06 -139.19 5.75 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.635 -0.793 . . . . 72.3 112.009 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.5 mt -91.21 129.18 42.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 120.776 0.322 . . . . 71.04 110.145 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.577 ' CD2' HD22 ' A' ' 15' ' ' LEU . 10.7 m170 -116.69 143.81 45.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.106 -0.497 . . . . 74.34 110.996 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 52.2 mt -110.73 126.16 68.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 108.138 -1.06 . . . . 75.21 108.138 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.58 HG12 ' CE2' ' A' ' 88' ' ' PHE . 20.2 mt -108.18 116.44 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.65 0.262 . . . . 71.44 111.295 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.7 tp -113.5 101.65 9.55 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 110.018 -0.364 . . . . 74.32 110.018 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.439 ' HD2' ' O ' ' A' ' 92' ' ' SER . 75.0 ttt180 -84.7 106.78 16.51 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.669 -0.412 . . . . 75.23 109.976 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.1 p -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.065 -0.516 . . . . 74.34 110.719 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.359 -0.829 . . . . 64.31 110.322 179.851 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.292 0 N-CA-C 111.83 -0.508 . . . . 60.35 111.83 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -72.14 128.83 36.89 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.711 0.291 . . . . 64.41 110.282 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -124.04 127.27 47.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.916 0.388 . . . . 74.21 112.018 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 87.2 mtp -88.51 71.88 8.88 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.34 -0.985 . . . . 75.43 108.34 175.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.82 138.35 31.84 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.25 -0.886 . . . . 75.4 109.837 -176.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.8 105.32 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.604 2.203 . . . . 51.51 112.212 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.03 -46.94 8.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.158 -0.474 . . . . 72.13 110.295 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -111.75 111.32 22.21 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.562 -0.903 . . . . 74.44 108.562 177.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.93 160.74 8.77 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-O 121.133 0.492 . . . . 62.2 111.796 -174.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.538 ' HB3' ' CG ' ' A' ' 117' ' ' GLU . 67.0 ttt180 -133.27 122.57 24.1 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 109.236 -0.653 . . . . 74.52 109.236 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.449 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 58.5 m -134.78 145.41 48.37 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.074 0.464 . . . . 74.33 111.336 -177.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -99.89 140.95 33.36 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.231 -1.026 . . . . 73.51 108.231 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.518 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 9.4 p80 -125.4 133.33 52.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.935 0.717 . . . . 74.41 112.935 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 6.5 tt -112.84 124.04 51.68 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.349 -1.352 . . . . 65.54 107.349 174.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -108.89 127.77 54.33 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 112.23 0.455 . . . . 51.43 112.23 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.3 p -118.03 114.0 43.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.354 -0.839 . . . . 52.35 108.943 174.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -85.16 175.62 8.86 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.031 -0.531 . . . . 63.4 111.166 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -145.15 165.59 27.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.108 -0.496 . . . . 73.13 110.701 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.41 ' HA ' ' O ' ' A' ' 32' ' ' ILE . 33.3 t -54.93 -52.21 63.68 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.682 0.614 . . . . 72.34 112.281 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -84.03 38.22 0.64 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.211 0.449 . . . . 52.41 112.211 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.4 t -91.54 162.63 14.45 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.973 -0.38 . . . . 73.41 109.973 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -12.52 60.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.228 0.537 . . . . 74.42 110.446 177.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -149.69 83.1 6.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.499 -0.773 . . . . 72.44 109.056 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -81.46 25.57 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.389 2.726 . . . . 53.14 112.576 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.0 p -122.9 138.9 54.53 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.522 -0.308 . . . . 71.51 110.67 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -136.11 -167.08 1.98 Allowed 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.421 -0.354 . . . . 75.32 110.285 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 68.6 p-90 -83.75 -19.51 35.01 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.257 -0.428 . . . . 74.23 110.429 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -102.73 -43.55 5.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.984 -0.553 . . . . 54.13 110.97 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -124.07 115.52 21.3 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.3 -0.63 . . . . 72.21 109.3 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -67.93 -31.2 70.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.393 -0.367 . . . . 74.04 110.605 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 20.6 ptmt -134.86 105.99 6.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.268 0.556 . . . . 75.21 111.02 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 19' ' ' SER . 28.4 mm -71.73 122.32 23.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.662 -0.699 . . . . 72.1 109.281 177.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.6 p -104.75 -17.85 14.47 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.653 0.263 . . . . 73.31 111.426 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -65.36 141.8 58.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.845 0.355 . . . . 73.21 110.327 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.9 t -97.59 -179.15 4.37 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.448 -0.342 . . . . 70.25 110.995 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -56.65 -47.64 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.911 -0.586 . . . . 62.32 111.464 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.502 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 10.8 mm-40 -59.18 -45.47 90.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.029 -0.532 . . . . 64.43 111.097 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.65 -38.84 92.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 54.21 110.505 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.546 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.12 -40.8 90.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 71.54 110.722 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.39 -38.98 89.01 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.244 -0.435 . . . . 71.33 110.433 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 49.2 mt-10 -63.54 -35.47 80.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 74.43 110.252 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.8 mt -70.02 -41.36 74.41 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.752 -0.658 . . . . 75.22 109.946 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.546 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.5 mm -53.51 -55.79 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.963 -0.562 . . . . 72.52 110.15 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.586 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.6 m-20 -57.26 -40.06 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.623 -0.717 . . . . 73.21 110.716 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.46 -46.83 93.28 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.98 -0.555 . . . . 71.11 112.181 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -60.62 -44.73 96.0 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.062 0.458 . . . . 74.14 109.909 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 43' ' ' ILE . 70.1 mt -56.88 -45.94 83.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-N 115.529 -0.76 . . . . 71.34 111.075 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 66.1 mm-40 -60.6 -44.76 95.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 72.31 110.979 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.469 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 66.4 mttm -62.18 -40.96 97.79 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.066 -0.516 . . . . 54.23 111.63 -177.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.5 mt -72.27 -47.82 51.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.184 -0.462 . . . . 63.04 111.475 -178.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.49 -26.6 65.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.526 0.565 . . . . 73.25 112.526 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -85.07 -1.19 56.56 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.879 0.371 . . . . 72.12 111.274 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.44 75.43 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.788 -0.72 . . . . 31.15 112.417 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -84.54 -54.98 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.449 -0.575 . . . . 73.33 109.449 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.469 ' OE2' ' HD3' ' A' ' 49' ' ' LYS . 43.3 mt-10 -133.37 176.48 8.49 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.23 -0.895 . . . . 74.24 109.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.482 ' O ' HD11 ' A' ' 60' ' ' LEU . 3.1 p30 -122.77 165.26 16.87 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.244 0.545 . . . . 75.11 111.683 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.465 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.5 t80 -61.84 -43.72 98.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.176 -0.92 . . . . 75.52 111.82 -176.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.468 ' CD ' HH21 ' A' ' 73' ' ' ARG . 45.6 mt-10 -64.29 -42.83 96.22 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.282 0.475 . . . . 72.21 112.282 -176.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.9 t -66.58 -34.93 79.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.136 0.494 . . . . 72.14 110.191 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.482 HD11 ' O ' ' A' ' 56' ' ' ASP . 10.5 mp -77.84 -29.69 50.63 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.894 -0.594 . . . . 73.32 111.11 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.96 -49.2 77.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.774 0.321 . . . . 74.45 111.281 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.454 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 26.4 m -75.13 12.04 1.0 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.431 0.53 . . . . 51.3 112.431 -178.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -133.77 -57.51 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.398 . . . . 74.32 111.731 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -93.61 21.27 6.49 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.925 -0.579 . . . . 74.02 112.439 -174.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.3 t -118.09 142.43 47.42 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.347 -0.541 . . . . 54.41 110.468 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -97.54 12.57 32.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.891 -0.595 . . . . 74.03 110.473 -178.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 36.1 t -98.38 144.4 27.8 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.211 -0.449 . . . . 64.53 110.807 -179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.1 m -71.14 -16.25 62.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 74.25 110.177 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -73.33 -6.78 48.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.019 -0.537 . . . . 74.31 110.693 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 62' ' ' SER . . . -67.09 -25.17 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.961 -0.563 . . . . 60.32 109.897 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -64.57 -35.04 79.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.343 -0.844 . . . . 75.22 109.488 177.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.0 19.08 3.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.538 -0.756 . . . . 70.23 110.894 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.468 HH21 ' CD ' ' A' ' 58' ' ' GLU . 18.9 mtp180 69.61 8.07 6.55 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.273 0.629 . . . . 72.35 111.785 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.19 -9.75 68.72 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.929 -0.653 . . . . 61.34 113.085 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.1 123.93 30.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.017 0.436 . . . . 62.14 111.535 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.3 mt -90.54 -25.38 20.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.677 -0.692 . . . . 73.23 111.028 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.52 -169.54 16.34 Favored Glycine 0 N--CA 1.434 -1.463 0 N-CA-C 111.072 -0.811 . . . . 45.14 111.072 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -86.57 109.91 19.45 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.077 0.465 . . . . 74.43 111.197 -178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -118.25 177.13 4.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.922 -0.581 . . . . 73.23 110.118 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.4 t -141.41 176.49 8.82 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.864 -0.421 . . . . 74.15 109.864 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.61 ' O ' ' HD2' ' A' ' 81' ' ' ARG . 6.9 ppt_? -60.42 128.79 38.42 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.37 0.605 . . . . 72.31 111.733 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 111.82 12.0 15.43 Favored Glycine 0 N--CA 1.437 -1.278 0 CA-C-N 115.317 -0.856 . . . . 72.15 111.354 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.97 -33.33 3.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.885 0.374 . . . . 74.43 110.907 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.449 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 44.1 tpp -112.62 165.31 12.38 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.827 0.346 . . . . 61.02 111.447 -176.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -74.57 148.49 40.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 61.45 110.052 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.2 tptt -40.69 -55.45 4.49 Favored Pre-proline 0 N--CA 1.484 1.248 0 N-CA-C 114.559 1.318 . . . . 74.35 114.559 -175.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 14.8 Cg_endo -55.77 -29.02 69.86 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.731 2.287 . . . . 73.14 113.787 -176.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.501 ' CE2' HG12 ' A' ' 113' ' ' ILE . 10.3 t80 -100.53 -39.76 7.76 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.062 0.458 . . . . 72.42 110.092 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.86 -64.28 0.96 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 75.32 111.414 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.35 -35.41 77.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.847 -0.615 . . . . 73.23 111.391 -176.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.543 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -65.41 -33.34 75.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 73.45 111.237 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.449 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 71.9 m -64.4 -28.48 69.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.012 0.434 . . . . 74.1 111.536 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.86 -7.27 57.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 75.52 110.569 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.72 -3.59 23.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.979 -0.555 . . . . 74.51 111.466 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.5 mt -99.96 135.97 40.58 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 74.32 111.137 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -98.15 166.53 11.37 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.787 -0.642 . . . . 74.41 110.382 178.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -57.28 123.25 14.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.878 0.371 . . . . 72.21 111.487 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.5 -6.99 77.96 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.76 -0.733 . . . . 72.11 112.28 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -93.24 143.92 25.8 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.989 -0.374 . . . . 73.1 109.989 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.7 ttp -135.08 136.16 41.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.202 -0.454 . . . . 73.25 110.935 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -99.6 123.0 43.45 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.962 -0.755 . . . . 72.34 108.962 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.35 -76.31 1.31 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.698 -0.763 . . . . 60.31 113.937 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.68 83.9 1.29 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.716 2.277 . . . . 74.45 113.862 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.511 ' HB ' ' O ' ' A' ' 111' ' ' HIS . 90.1 t -116.6 102.85 14.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.155 -0.683 . . . . 53.44 109.155 175.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -83.59 122.69 28.92 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.131 0.491 . . . . 72.55 111.667 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.535 HG23 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -131.61 -168.49 2.03 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.857 -0.794 . . . . 73.43 108.857 178.338 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.535 ' H ' HG23 ' A' ' 106' ' ' THR . 5.5 m-20 -55.0 -56.08 23.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.449 0.537 . . . . 62.23 112.449 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.3 p -71.44 -30.63 66.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.775 0.657 . . . . 71.45 112.775 -177.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -138.33 6.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.311 -0.947 . . . . 62.43 111.892 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 49.3 mt -91.7 127.67 43.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 120.929 0.395 . . . . 71.21 110.528 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.511 ' O ' ' HB ' ' A' ' 104' ' ' VAL . 13.5 m-70 -110.56 128.96 55.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.894 -0.593 . . . . 73.41 109.886 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.518 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.6 mt -99.38 123.51 52.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.895 -0.779 . . . . 72.43 108.895 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.501 HG12 ' CE2' ' A' ' 88' ' ' PHE . 14.8 mt -107.37 113.9 44.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.138 -0.483 . . . . 73.25 110.982 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 54.0 tp -104.55 123.81 48.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.554 -0.294 . . . . 74.44 110.54 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -87.58 99.16 11.84 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.833 -0.432 . . . . 70.21 109.833 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.5 p -80.87 -46.09 15.81 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.968 -0.56 . . . . 72.21 111.699 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.538 ' CG ' ' HB3' ' A' ' 10' ' ' ARG . 70.8 mm-40 . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.695 -0.669 . . . . 75.44 111.045 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.214 0 N-CA-C 111.823 -0.511 . . . . 60.01 111.823 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -66.64 -33.13 74.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 74.44 110.629 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -96.71 130.66 43.9 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.922 -0.581 . . . . 72.35 109.7 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 61.3 mtt -75.42 128.53 35.56 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.514 -0.55 . . . . 73.21 109.514 177.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 73.0 153.45 0.15 Allowed Pre-proline 0 C--O 1.238 0.464 0 O-C-N 124.021 0.826 . . . . 65.04 110.152 -178.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -57.96 129.27 32.4 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 122.257 1.971 . . . . 75.53 111.404 177.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.85 -57.86 5.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.497 -0.319 . . . . 71.55 110.479 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -106.98 142.14 37.07 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.657 -0.497 . . . . 73.11 109.657 177.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.539 HG12 ' NH1' ' A' ' 115' ' ' ARG . 25.9 m -139.38 129.46 31.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 120.878 0.37 . . . . 71.44 111.384 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 0.7 OUTLIER -100.24 107.38 19.2 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 107.806 -1.183 . . . . 75.04 107.806 171.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.3 m -133.32 144.7 49.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.806 -0.634 . . . . 74.51 111.367 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -103.52 155.8 18.25 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.536 -0.913 . . . . 73.15 108.536 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.5 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.2 p80 -137.68 141.57 41.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.861 0.689 . . . . 74.44 112.861 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.501 HD22 ' N ' ' A' ' 15' ' ' LEU . 7.4 tt -115.44 143.23 45.6 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.796 -1.187 . . . . 74.24 107.796 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.52 HD11 ' CE1' ' A' ' 111' ' ' HIS . 40.7 tp -126.8 124.65 40.16 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.998 0.427 . . . . 74.25 111.9 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.1 t -112.81 118.39 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 115.445 -0.798 . . . . 74.34 109.056 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -86.5 -173.99 4.79 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.5 0.667 . . . . 74.42 111.284 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -160.65 172.96 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.062 -0.972 . . . . 72.33 108.498 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.7 m -54.05 -42.52 69.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.922 0.342 . . . . 64.2 111.922 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -88.43 54.95 3.22 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 75.21 111.597 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 t -108.03 170.07 8.23 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.827 -0.434 . . . . 73.31 109.827 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.505 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -73.28 -30.3 63.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.358 0.599 . . . . 71.11 109.923 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -134.81 94.81 16.17 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.555 -0.748 . . . . 75.11 109.45 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.448 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 85.6 Cg_endo -80.01 33.69 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 74.43 112.263 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -143.66 126.57 16.27 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.937 -0.574 . . . . 73.51 109.741 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.3 m -135.6 175.64 9.41 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.398 -0.364 . . . . 72.02 110.627 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -73.28 -14.0 61.23 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.191 -0.459 . . . . 75.32 111.203 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -91.15 -44.24 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 74.23 110.548 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -136.31 134.45 37.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.928 -0.578 . . . . 65.21 110.192 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.43 -47.84 83.94 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.069 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 60.7 pttt -126.66 113.43 16.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.051 0.453 . . . . 70.4 110.485 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.45 104.14 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.703 -0.681 . . . . 74.21 110.199 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.5 m -114.63 96.44 5.75 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 116.017 -0.538 . . . . 73.21 110.221 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -167.47 134.35 2.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.822 -0.626 . . . . 65.4 110.09 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 t -74.99 174.74 8.9 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.735 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -58.05 -38.18 75.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.824 0.345 . . . . 74.54 110.577 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.7 mt-10 -58.02 -46.39 85.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.784 -0.644 . . . . 74.11 110.772 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 74.5 mm-40 -59.96 -43.46 95.04 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.14 111.104 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.12 96.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.02 -0.536 . . . . 74.32 110.254 178.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.7 tp -63.73 -43.76 95.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.671 -0.695 . . . . 63.14 110.667 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 64.6 mm-40 -59.95 -43.03 95.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.08 -0.509 . . . . 73.52 110.754 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 83.9 mt -63.89 -48.71 75.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.331 -0.395 . . . . 75.04 110.664 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 30.6 mm -55.49 -56.98 9.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.076 -0.511 . . . . 63.03 111.053 179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 39.7 m-80 -60.07 -35.95 76.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.266 -0.425 . . . . 71.24 110.892 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.31 -49.48 75.73 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.768 -0.651 . . . . 24.42 111.979 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.402 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 26.6 m-85 -61.24 -47.1 87.62 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.978 -0.378 . . . . 74.32 109.978 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.7 mt -51.12 -51.48 21.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.73 -0.668 . . . . 63.32 111.21 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.492 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 68.4 mm-40 -63.18 -40.11 96.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.485 -0.325 . . . . 73.33 111.149 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -62.39 -47.14 85.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.945 0.402 . . . . 63.43 110.957 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.77 -46.02 83.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.914 -0.584 . . . . 75.12 111.369 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -64.45 -38.55 91.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.431 -0.349 . . . . 54.21 111.527 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.1 t -70.62 -20.86 62.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.9 0.381 . . . . 64.31 110.836 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 94.3 18.4 36.41 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.68 -0.771 . . . . 63.32 112.452 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.2 -66.46 0.54 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.184 0.516 . . . . 71.13 111.053 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -137.38 161.88 35.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.518 -0.765 . . . . 73.44 110.692 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -78.7 144.87 34.9 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.048 -0.524 . . . . 74.22 112.089 -177.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.04 -41.73 94.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.662 -0.699 . . . . 74.52 110.055 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -59.83 -33.26 71.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.813 -0.631 . . . . 75.42 110.755 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.9 t -77.89 -34.52 51.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.985 -0.552 . . . . 72.21 110.619 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 99.1 mt -76.71 -40.85 47.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.475 -0.33 . . . . 75.44 111.157 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.58 -16.44 63.86 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.252 0.464 . . . . 75.34 112.252 -177.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.5 p -95.08 -4.65 45.95 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.739 0.304 . . . . 65.13 111.447 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -126.01 -58.68 1.37 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 120.872 0.368 . . . . 70.34 111.909 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.402 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 88.5 m-85 -93.94 38.4 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.257 -0.429 . . . . 72.31 112.058 -174.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -121.63 128.62 52.11 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.198 -0.668 . . . . 65.34 109.198 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -69.37 -28.72 66.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.089 0.471 . . . . 74.25 110.755 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 p -61.83 143.98 55.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 65.22 111.295 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.2 m -74.56 -8.55 56.7 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.195 0.522 . . . . 73.42 110.742 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.7 m -70.46 -4.47 22.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 62.22 111.058 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.53 -32.57 51.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.018 -0.537 . . . . 72.41 111.889 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -66.24 -33.28 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 72.53 110.74 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.62 7.48 36.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.64 -0.504 . . . . 61.43 109.64 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? 64.92 18.37 11.46 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.342 -0.844 . . . . 74.4 110.87 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 67.76 19.88 71.75 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.719 -0.673 . . . . 50.32 112.577 -179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.74 139.05 31.06 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.872 0.336 . . . . 63.22 111.14 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.0 mt -115.21 2.38 14.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.171 -0.468 . . . . 73.24 110.766 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.547 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 71.63 -154.94 51.84 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.36 -0.924 . . . . 72.33 111.062 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -91.87 108.39 19.89 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.859 0.362 . . . . 70.23 110.299 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.42 171.93 7.53 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.156 -0.474 . . . . 71.54 110.675 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.2 t -160.7 171.66 18.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.826 0.346 . . . . 71.45 111.43 -177.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 64.48 -82.38 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.31 1.044 . . . . 73.34 112.91 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.465 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -174.43 86.68 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.581 -0.819 . . . . 21.35 112.134 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -102.07 -24.07 14.0 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.483 -0.562 . . . . 54.4 109.483 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.403 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 35.8 tpp -113.86 172.12 7.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.54 -0.754 . . . . 71.25 109.517 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.96 141.56 33.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.45 0.167 . . . . 72.25 111.221 178.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.426 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.5 tptm -50.32 -50.5 70.46 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 113.645 0.98 . . . . 64.53 113.645 -176.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.426 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 77.0 Cg_exo -52.52 -35.32 66.18 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 121.993 1.796 . . . . 71.32 112.262 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.403 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 38.1 t80 -82.11 -50.14 9.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.746 -0.661 . . . . 73.01 110.308 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.465 ' HG2' ' HA2' ' A' ' 82' ' ' GLY . 2.5 tp10 -61.25 -30.04 70.21 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.857 -0.61 . . . . 71.1 111.036 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.6 -29.68 70.2 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.756 -0.657 . . . . 75.15 110.376 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.57 -24.48 21.71 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.771 -0.65 . . . . 61.34 110.922 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 m -58.82 -41.18 86.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.987 0.422 . . . . 64.44 111.077 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -91.24 12.84 18.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 74.13 111.179 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.47 -26.56 26.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.726 0.298 . . . . 72.23 111.26 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.35 127.77 32.5 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.255 -0.429 . . . . 75.15 110.497 -178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -86.01 -67.21 0.83 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.267 -0.424 . . . . 75.44 111.145 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 65.3 m -138.67 108.06 6.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.61 -0.268 . . . . 73.12 111.34 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.559 ' HA2' ' O ' ' A' ' 115' ' ' ARG . . . 51.56 44.5 53.87 Favored Glycine 0 C--N 1.332 0.337 0 CA-C-N 115.926 -0.579 . . . . 72.55 113.163 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -106.77 161.48 14.63 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 122.692 -0.299 . . . . 74.42 110.745 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.4 ttp -124.7 135.6 53.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.201 -0.454 . . . . 54.5 110.239 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.8 t -89.79 151.39 21.82 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.613 -0.514 . . . . 74.33 109.613 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.54 -144.92 4.59 Favored Glycine 0 N--CA 1.44 -1.04 0 C-N-CA 121.011 -0.614 . . . . 34.43 112.756 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.87 103.36 1.0 Allowed 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.67 2.247 . . . . 73.3 113.184 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -92.89 109.58 21.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.054 -0.521 . . . . 71.45 109.669 177.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -82.28 127.89 33.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.283 -0.417 . . . . 75.23 111.457 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 38.8 p -138.08 -166.16 1.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.806 -0.634 . . . . 61.54 110.165 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -70.43 -47.3 61.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.791 0.329 . . . . 72.1 111.33 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -69.45 -37.77 77.5 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.227 -0.442 . . . . 75.33 111.377 -177.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.93 -138.95 5.68 Favored Glycine 0 N--CA 1.441 -0.993 0 C-N-CA 120.766 -0.73 . . . . 70.04 111.696 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.5 mt -108.4 135.9 45.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 110.107 -0.331 . . . . 71.34 110.107 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.52 ' CE1' HD11 ' A' ' 15' ' ' LEU . 39.7 m-70 -120.4 152.59 37.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.717 0.294 . . . . 74.23 110.784 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.5 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 62.9 mt -115.46 128.3 72.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.004 -1.11 . . . . 72.01 108.004 173.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.8 mt -116.24 123.08 71.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.542 0.21 . . . . 72.01 111.112 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.0 tp -120.45 120.96 37.43 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.619 -0.264 . . . . 72.2 111.07 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.559 ' O ' ' HA2' ' A' ' 98' ' ' GLY . 18.8 ttt180 -89.08 119.36 29.52 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.576 -0.898 . . . . 71.53 108.576 175.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 m -85.82 -12.9 49.67 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 120.852 0.358 . . . . 75.31 111.344 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.58 -0.724 . . . . 74.24 110.858 -179.746 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.236 0 N-CA-C 111.778 -0.529 . . . . 73.34 111.778 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -148.11 155.56 41.58 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 116.903 0.352 . . . . 72.55 110.509 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -81.98 -23.68 35.91 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.377 -0.601 . . . . 72.15 109.377 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -85.03 95.68 9.17 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.489 -0.778 . . . . 74.22 109.227 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -74.71 131.48 79.51 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.76 -0.655 . . . . 75.31 110.768 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.87 163.53 38.12 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 123.138 2.559 . . . . 63.02 113.022 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -94.22 -12.39 28.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.12 -0.491 . . . . 72.22 111.228 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -117.59 121.95 42.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.302 -0.408 . . . . 65.5 110.559 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.5 m -136.23 150.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 116.247 -0.433 . . . . 72.13 110.714 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -110.44 114.71 28.35 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.914 -0.773 . . . . 62.54 108.914 176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m -129.01 152.55 48.5 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.25 0.548 . . . . 72.3 111.677 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -104.71 149.93 25.17 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.245 -1.02 . . . . 75.33 108.245 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -139.81 149.29 43.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.706 0.632 . . . . 72.02 112.706 -176.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.507 ' HA ' ' OG ' ' A' ' 65' ' ' SER . 8.8 tt -118.49 131.43 56.25 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.361 -0.977 . . . . 73.15 108.361 175.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.606 ' O ' ' HA ' ' A' ' 65' ' ' SER . 2.6 tm? -123.69 112.12 17.0 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.847 0.356 . . . . 71.22 110.535 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.3 p -109.99 122.23 64.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.429 0.633 . . . . 70.55 110.605 178.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -85.03 177.46 7.92 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.597 -0.729 . . . . 75.23 110.922 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.32 173.85 15.07 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.015 -0.539 . . . . 71.45 110.371 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.1 p -56.64 -53.59 55.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.258 0.466 . . . . 74.5 112.258 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -89.83 47.16 1.43 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.12 0.486 . . . . 73.5 110.696 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.2 t -92.3 173.91 7.57 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.977 -0.556 . . . . 42.53 110.419 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.44 ' HD2' ' OD1' ' A' ' 107' ' ' ASP . 46.6 ttt180 -68.89 -22.38 64.19 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.494 -0.928 . . . . 74.34 108.494 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.4 ' C ' ' H ' ' A' ' 25' ' ' SER . 24.2 tpp180 -150.46 98.61 3.24 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 114.562 -1.199 . . . . 71.42 108.746 176.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.402 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 71.8 Cg_endo -76.14 26.07 0.42 Allowed 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.214 2.609 . . . . 73.11 112.971 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.4 ' H ' ' C ' ' A' ' 23' ' ' ARG . 30.9 m -130.92 147.39 52.56 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.986 -0.552 . . . . 72.31 109.565 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.4 p -134.31 -178.42 5.04 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.88 0.371 . . . . 72.41 110.337 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 66' ' ' ASP . 44.4 p-90 -81.53 -0.78 43.57 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.587 -0.523 . . . . 75.32 109.587 175.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -102.36 -52.55 3.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.565 -0.743 . . . . 73.25 110.261 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -132.65 165.23 24.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.34 111.462 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.69 -38.91 28.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.034 -0.53 . . . . 53.12 111.184 -177.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 17.9 ptmt -135.67 125.58 25.79 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 120.936 0.398 . . . . 54.31 111.172 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.15 122.07 34.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.992 -0.549 . . . . 75.14 109.811 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.0 m -86.84 -40.44 14.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.579 0.228 . . . . 74.54 111.104 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -63.33 125.87 25.57 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.364 0.602 . . . . 75.33 111.804 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.6 t -81.85 171.25 14.71 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.737 -0.665 . . . . 75.23 109.903 177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -58.82 -33.48 70.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.887 0.375 . . . . 74.33 110.575 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.43 -41.97 98.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.91 -0.586 . . . . 75.45 110.807 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -71.25 -39.74 71.45 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.966 -0.561 . . . . 71.32 110.466 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.39 -40.22 96.63 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.669 -0.696 . . . . 71.43 110.823 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.87 -43.76 77.44 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.144 -0.48 . . . . 73.25 111.603 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -58.45 -45.96 87.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.166 0.507 . . . . 62.3 110.287 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.77 -46.56 74.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.5 -0.773 . . . . 64.3 110.563 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.478 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.2 mm -56.55 -53.67 38.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.896 -0.593 . . . . 70.03 111.283 -179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -54.72 -45.27 74.03 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 120.976 0.417 . . . . 75.14 110.664 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.441 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.73 -54.14 40.1 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.461 -0.791 . . . . 73.22 112.52 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.52 ' O ' HG13 ' A' ' 50' ' ' ILE . 28.5 m-85 -57.36 -46.1 83.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 111.71 0.263 . . . . 64.43 111.71 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.401 HG21 ' HE2' ' A' ' 100' ' ' MET . 68.4 mt -55.17 -42.13 63.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 121.053 0.454 . . . . 75.21 110.871 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -74.34 -37.76 63.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.18 -0.464 . . . . 71.3 111.194 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 93.5 mttt -66.84 -33.78 76.37 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.472 -0.331 . . . . 73.23 111.131 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.589 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 89.5 mt -63.55 -43.07 98.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.966 0.412 . . . . 73.01 110.135 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -76.07 -1.67 27.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.068 -0.515 . . . . 75.11 111.139 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.4 t -103.24 -1.96 28.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.101 -0.5 . . . . 74.31 110.118 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.48 2.38 90.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.996 -0.621 . . . . 74.14 113.06 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -68.56 -65.49 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.993 0.425 . . . . 52.34 110.554 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.589 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 61.3 mm-40 -119.64 151.53 38.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.887 -0.597 . . . . 74.35 110.139 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -97.6 152.87 18.61 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.355 -0.609 . . . . 54.54 109.355 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -53.8 -40.09 66.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.527 -0.306 . . . . 75.43 111.711 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -65.85 -19.34 65.84 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 73.03 111.621 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 t -75.44 -38.0 59.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.108 0.48 . . . . 54.54 110.444 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.15 -40.64 13.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.122 -0.49 . . . . 63.45 111.112 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.67 -32.12 68.82 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.131 0.419 . . . . 62.21 112.131 -177.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.421 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 28.6 p -82.66 -14.39 54.76 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.248 0.462 . . . . 54.34 112.248 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -124.12 18.23 9.18 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.324 0.49 . . . . 74.53 112.324 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -139.31 -42.06 0.46 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 111.801 0.297 . . . . 64.51 111.801 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.606 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.6 m -64.57 132.09 48.86 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.176 0.512 . . . . 74.34 112.365 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.487 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . 20.8 t70 -84.6 -22.46 29.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.791 -0.641 . . . . 74.43 109.444 174.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -59.34 151.44 23.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.218 -0.901 . . . . 73.34 110.984 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.2 m -61.25 -13.12 16.29 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.278 0.473 . . . . 51.41 112.278 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 m -76.87 -6.19 51.41 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.592 -0.276 . . . . 70.35 111.186 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.421 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -55.93 -54.78 40.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.912 0.387 . . . . 72.01 111.337 -178.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -71.69 -8.41 53.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.941 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.78 13.75 32.63 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.913 -0.585 . . . . 42.04 110.174 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 69.91 15.71 7.8 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.267 -0.879 . . . . 71.12 112.57 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.77 -22.17 41.64 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.124 -0.56 . . . . 72.41 113.031 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.24 131.38 49.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.718 0.636 . . . . 74.53 112.718 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.41 -18.39 16.75 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 72.42 111.04 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.61 -175.43 40.56 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 110.898 -0.881 . . . . 51.54 110.898 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.79 122.53 24.2 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.904 0.352 . . . . 63.33 110.732 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -133.91 179.2 6.39 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.341 -0.39 . . . . 74.13 110.399 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -133.21 175.82 9.05 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 120.749 0.309 . . . . 64.13 110.317 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -78.78 156.38 28.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 74.14 111.391 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.01 28.38 28.67 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 116.051 -0.522 . . . . 74.54 111.961 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -127.91 -51.8 1.33 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.748 0.277 . . . . 75.11 111.748 -178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -91.91 175.61 6.82 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.749 0.309 . . . . 52.4 110.793 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -65.28 139.33 58.6 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.762 -0.459 . . . . 73.31 109.762 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.474 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.0 tptm -51.37 -52.06 63.07 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 113.456 0.91 . . . . 73.04 113.456 -175.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.6 Cg_endo -53.57 -27.33 40.73 Favored 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.419 2.079 . . . . 64.21 112.906 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -93.28 -50.86 5.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.089 0.471 . . . . 71.41 110.56 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -61.94 -46.24 90.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.64 -0.709 . . . . 64.52 111.324 -177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.29 -40.14 89.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.081 -0.509 . . . . 73.45 110.608 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.29 -31.97 71.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.874 -0.603 . . . . 74.12 110.804 179.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 m -68.65 -46.09 70.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.12 -0.491 . . . . 72.54 110.853 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -77.18 -10.23 59.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 74.25 111.619 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.23 8.51 32.74 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.116 0.484 . . . . 63.33 110.496 178.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 79.3 mt -101.57 131.75 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.857 -0.61 . . . . 64.34 110.581 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.5 mtm180 -76.87 172.75 12.63 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.269 -0.423 . . . . 71.44 110.106 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.0 m -55.42 111.88 0.98 Allowed 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.033 0.444 . . . . 74.32 111.868 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.32 49.77 11.42 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.801 -0.636 . . . . 61.35 112.765 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -129.19 156.26 44.22 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.878 0.371 . . . . 62.13 110.995 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.401 ' HE2' HG21 ' A' ' 47' ' ' ILE . 40.1 ttp -118.3 136.12 53.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.887 -0.597 . . . . 70.5 110.759 -179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.3 t -83.67 159.54 21.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.017 -0.538 . . . . 75.31 110.902 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.0 -171.09 44.28 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 111.33 -0.708 . . . . 32.25 111.33 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -65.44 107.01 0.93 Allowed 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.872 2.381 . . . . 72.22 112.774 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 91.1 t -89.68 120.56 38.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.63 -0.507 . . . . 70.52 109.63 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -95.85 133.37 40.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.057 0.456 . . . . 74.31 111.226 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 33.9 p -142.88 -173.71 3.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.882 -0.599 . . . . 74.45 110.189 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.44 ' OD1' ' HD2' ' A' ' 22' ' ' ARG . 2.1 p30 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 72.15 111.078 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.9 p -84.43 -41.83 16.24 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.442 . . . . 75.34 110.82 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.89 -149.84 18.67 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 120.696 -0.764 . . . . 60.41 111.945 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.4 mt -98.44 133.01 42.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.72 -0.474 . . . . 70.34 109.72 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -117.03 129.13 55.81 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.276 -0.42 . . . . 72.11 110.698 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 32.0 mt -107.49 137.5 38.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.784 -1.191 . . . . 60.24 107.784 173.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 24.4 mt -124.88 129.83 73.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.786 -0.366 . . . . 73.35 111.172 -176.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.3 tp -122.71 116.23 23.41 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.257 -0.645 . . . . 74.43 109.257 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -78.35 120.08 22.6 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.366 -0.533 . . . . 75.41 110.87 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 16.7 m -85.63 -60.73 1.94 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.581 -0.736 . . . . 63.12 109.898 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.31 -0.852 . . . . 62.45 110.199 179.686 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.05 0 N-CA-C 111.396 -0.681 . . . . 71.45 111.396 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -145.15 147.24 32.27 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.726 0.298 . . . . 52.41 110.639 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.95 -14.67 13.92 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.208 0.527 . . . . 75.24 110.487 178.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.428 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 80.1 mtp -116.77 100.28 7.69 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.379 -0.971 . . . . 62.01 108.379 177.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 4' ' ' MET . 0.7 OUTLIER 71.17 156.67 0.16 Allowed Pre-proline 0 N--CA 1.472 0.628 0 O-C-N 123.719 0.637 . . . . 73.15 110.633 -175.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.5 166.74 18.74 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.065 1.843 . . . . 63.34 111.667 178.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.74 -53.89 2.66 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 120.898 0.38 . . . . 65.13 110.843 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 mtm180 -99.34 106.76 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.273 -0.421 . . . . 73.42 110.275 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.7 m -134.81 154.18 36.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-O 121.077 0.465 . . . . 75.35 111.665 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -117.7 137.9 52.37 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.842 -0.799 . . . . 75.55 108.842 174.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.2 m -146.74 148.53 32.05 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.959 0.409 . . . . 75.32 110.933 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.5 m -102.06 148.52 25.28 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.202 -1.036 . . . . 65.31 108.202 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.47 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.8 p80 -136.75 132.21 34.47 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.833 0.679 . . . . 71.24 112.833 -176.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.21 124.8 50.83 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.985 -1.117 . . . . 72.53 107.985 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 111' ' ' HIS . 28.8 tp -120.8 124.24 44.59 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.02 0.438 . . . . 75.42 111.777 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.85 115.66 50.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.414 -0.812 . . . . 65.53 108.969 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -83.31 175.09 10.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.091 0.472 . . . . 74.3 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -152.12 162.3 41.31 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.832 -0.622 . . . . 74.31 110.048 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -56.28 -49.71 73.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.245 0.545 . . . . 74.01 111.13 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -80.01 40.28 0.47 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.677 -0.692 . . . . 74.01 111.638 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.7 t -105.98 -173.35 2.28 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.285 -0.635 . . . . 72.0 109.285 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 mtp85 -72.44 -23.92 61.14 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.294 0.568 . . . . 75.41 109.722 179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HG2' ' H ' ' A' ' 25' ' ' SER . 19.4 ttm180 -146.59 114.13 4.39 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 71.04 110.055 177.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -87.18 21.89 1.0 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.921 2.414 . . . . 64.33 111.631 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.419 ' H ' ' HG2' ' A' ' 23' ' ' ARG . 15.6 m -126.3 148.1 49.6 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.768 -0.651 . . . . 62.1 109.877 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.8 t -146.94 -179.3 6.71 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.875 -0.417 . . . . 60.02 109.875 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 54.9 p-90 -84.71 -35.75 22.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.056 0.455 . . . . 74.22 110.573 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.423 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 3.3 ptm180 -81.0 -21.67 40.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.932 -0.576 . . . . 73.24 110.781 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -151.8 121.86 7.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.883 -0.599 . . . . 75.44 109.48 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.0 -41.69 90.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.307 -0.406 . . . . 74.41 111.345 -176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -122.71 109.24 14.0 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.159 0.504 . . . . 73.32 111.522 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.1 mm -79.04 105.8 8.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.744 -0.836 . . . . 71.43 108.744 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 47.6 p -87.75 -21.89 24.89 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.107 -0.497 . . . . 54.31 112.232 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.0 ptp85 -66.34 131.77 46.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.074 0.464 . . . . 75.21 111.104 -177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -86.76 -179.77 6.62 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.921 -0.582 . . . . 74.43 110.258 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.64 -43.31 99.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.68 0.276 . . . . 72.5 110.986 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.58 -40.07 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 74.34 110.869 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.93 -36.49 64.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 73.44 110.715 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.42 94.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.101 -0.5 . . . . 72.32 110.769 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.97 -42.12 93.44 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.385 -0.37 . . . . 72.11 110.91 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -65.73 -42.36 91.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 72.33 110.973 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.43 -52.34 58.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 71.33 110.925 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.7 mm -53.45 -56.5 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 O-C-N 123.457 0.473 . . . . 64.14 111.848 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.572 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 51.0 m-80 -61.99 -36.67 82.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.714 0.292 . . . . 73.14 111.101 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.541 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -62.44 -47.03 92.43 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.862 -0.685 . . . . 71.32 111.926 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.447 ' O ' HG13 ' A' ' 50' ' ' ILE . 21.7 m-85 -57.38 -42.39 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.599 0.238 . . . . 74.5 110.907 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.47 -41.95 79.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.144 0.497 . . . . 41.32 110.505 178.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 71.8 mm-40 -66.73 -42.13 86.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.984 -0.553 . . . . 74.32 110.682 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.541 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.0 mtpp -58.92 -40.7 85.35 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.186 -0.461 . . . . 65.52 110.703 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 46' ' ' TYR . 82.3 mt -64.89 -42.87 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.703 -0.68 . . . . 74.32 110.996 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -69.09 -33.17 73.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.429 -0.351 . . . . 71.45 111.466 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -78.74 -16.03 57.71 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.01 0.434 . . . . 75.32 110.978 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.72 15.89 67.0 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.848 -0.691 . . . . 61.51 112.45 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -67.61 -58.29 4.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.21 0.529 . . . . 73.13 109.873 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -132.6 143.07 49.44 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.434 -0.803 . . . . 70.3 109.783 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -76.17 157.87 32.28 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 116.185 -0.461 . . . . 75.12 110.787 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -58.59 -43.9 89.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.506 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.387 -0.824 . . . . 70.15 110.488 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.3 t -65.24 -47.02 78.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.951 -0.568 . . . . 74.33 110.163 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.81 -37.16 81.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.004 -0.544 . . . . 70.01 111.075 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -65.53 -48.69 71.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.308 -0.406 . . . . 72.12 111.526 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -76.78 7.92 4.22 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.9 0.704 . . . . 51.41 112.9 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -135.6 -51.82 0.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.621 0.6 . . . . 71.4 112.621 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -96.27 -10.11 28.69 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.645 0.609 . . . . 71.12 112.645 -174.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.496 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 33.1 t -87.04 140.52 29.47 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.717 -0.393 . . . . 70.1 110.389 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.423 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 3.7 m-20 -93.46 13.71 20.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.996 0.427 . . . . 73.11 110.005 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.412 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 47.4 t -76.09 146.86 39.03 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.113 -0.494 . . . . 61.54 110.531 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.6 t -75.98 -20.49 57.83 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.854 -0.795 . . . . 73.23 108.854 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.38 -4.72 59.06 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.223 -0.899 . . . . 61.25 110.403 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 61' ' ' ALA . . . -58.13 -30.75 66.58 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.103 -0.499 . . . . 42.44 111.04 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -61.83 -26.48 68.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.967 -0.56 . . . . 73.24 110.608 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.73 24.44 8.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.941 -0.572 . . . . 65.2 110.135 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 68.2 13.71 9.12 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.911 -0.586 . . . . 72.12 111.274 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.71 12.01 78.48 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.576 -0.821 . . . . 62.02 111.848 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -65.88 126.17 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.923 0.392 . . . . 45.3 111.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -15.38 25.8 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.34 -0.615 . . . . 74.11 109.34 177.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.34 -166.56 48.03 Favored Glycine 0 N--CA 1.433 -1.561 0 C-N-CA 120.745 -0.74 . . . . 75.41 111.382 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -87.43 109.93 19.92 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.801 0.334 . . . . 62.31 110.261 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -116.06 151.36 35.68 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.135 -0.484 . . . . 73.2 109.993 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 13.4 m -149.81 177.48 9.77 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.586 -0.279 . . . . 75.54 111.124 -177.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 67.17 10.75 7.95 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.529 -0.759 . . . . 63.32 112.38 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 67.71 31.85 76.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.032 -0.604 . . . . 72.31 112.882 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -82.26 79.05 8.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.155 0.502 . . . . 75.15 110.678 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.5 tpp -178.26 164.0 1.71 Allowed 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.964 -1.016 . . . . 60.2 108.376 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -58.0 139.72 53.88 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.573 0.225 . . . . 74.3 110.572 177.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 53.0 tptt -55.02 -48.63 95.56 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 113.113 0.782 . . . . 70.04 113.113 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 61.1 Cg_exo -53.12 -37.89 80.13 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 121.97 1.78 . . . . 72.44 111.874 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -76.26 -43.79 40.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.42 -0.809 . . . . 74.32 109.707 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.74 -50.21 74.71 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.668 -0.697 . . . . 71.12 111.472 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -54.6 -32.45 58.74 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.958 -0.564 . . . . 73.01 111.867 -177.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.562 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -86.77 -42.18 13.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.473 -0.33 . . . . 75.54 111.407 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -64.9 -44.85 88.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.96 0.409 . . . . 75.43 111.66 -177.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -79.13 -0.79 33.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.304 -0.407 . . . . 74.54 111.34 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.63 -2.9 24.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.138 -0.483 . . . . 60.41 110.298 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.3 mt -84.5 140.8 31.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.062 -0.517 . . . . 73.41 110.778 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.99 -174.61 3.02 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.847 -0.615 . . . . 74.11 109.59 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.5 m -72.88 100.9 3.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.933 0.397 . . . . 74.5 110.449 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.23 19.77 20.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.879 -0.677 . . . . 52.3 111.771 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -104.84 147.29 27.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.831 0.348 . . . . 74.54 110.694 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.415 ' SD ' HD12 ' A' ' 114' ' ' LEU . 56.4 ttp -133.4 135.28 44.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.038 -0.528 . . . . 71.0 110.203 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.422 ' HB2' HD23 ' A' ' 95' ' ' LEU . 16.5 t -92.86 161.62 14.42 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.526 -0.546 . . . . 33.33 109.526 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.11 -144.25 6.89 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 120.648 -0.786 . . . . 64.03 112.19 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.4 103.62 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.501 2.134 . . . . 72.21 112.427 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.72 107.08 19.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.76 -0.459 . . . . 75.25 109.76 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -73.28 112.32 9.23 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.195 0.521 . . . . 74.15 111.037 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.402 HG23 ' H ' ' A' ' 107' ' ' ASP . 1.9 m -120.85 169.47 10.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.588 -0.733 . . . . 63.41 109.48 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.402 ' H ' HG23 ' A' ' 106' ' ' THR . 1.9 m-20 -51.71 -46.45 63.95 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.694 0.627 . . . . 63.12 112.694 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 p -77.7 -16.43 58.48 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.552 0.575 . . . . 54.54 112.552 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 146.15 -158.36 27.67 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.514 -0.851 . . . . 51.21 111.773 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 34.6 mt -87.73 126.2 41.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 120.858 0.361 . . . . 74.22 110.423 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.47 ' CD2' HD13 ' A' ' 15' ' ' LEU . 14.4 m-70 -115.23 133.35 56.11 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.107 -0.497 . . . . 73.13 110.274 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 42.3 mt -101.2 124.34 54.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 N-CA-C 107.606 -1.257 . . . . 70.51 107.606 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.1 mt -112.74 132.78 60.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 C-N-CA 120.813 -0.355 . . . . 75.33 111.32 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.415 HD12 ' SD ' ' A' ' 100' ' ' MET . 8.5 tt -133.65 131.39 39.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.193 -0.458 . . . . 64.43 109.983 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -118.69 130.26 55.74 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.922 -0.399 . . . . 64.32 109.922 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.33 0.57 14.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.858 0.318 . . . . 74.11 111.858 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 118.438 -0.791 . . . . 41.41 110.831 -178.897 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 111.851 -0.5 . . . . 74.22 111.851 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 t -84.4 -57.78 3.01 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.696 0.284 . . . . 70.11 110.438 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -76.14 -42.03 48.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.087 0.47 . . . . 75.22 109.969 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.4 ttt -88.15 111.91 22.13 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.231 -0.655 . . . . 74.42 109.231 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 29.1 mt-10 -68.48 126.09 92.35 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.065 -0.516 . . . . 71.35 110.7 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 36.2 Cg_exo -60.97 152.94 67.37 Favored 'Trans proline' 0 C--O 1.237 0.425 0 C-N-CA 122.827 2.351 . . . . 74.43 112.541 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.61 -19.4 49.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.833 -0.621 . . . . 64.01 109.732 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -133.0 127.41 34.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.404 -0.816 . . . . 70.02 109.912 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.9 m -131.9 166.75 28.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 116.328 -0.397 . . . . 44.45 110.029 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 58.5 ttt180 -123.75 128.28 49.35 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.699 0.285 . . . . 74.34 110.867 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -134.32 138.72 45.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.856 -0.611 . . . . 74.13 110.518 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.4 m -96.92 158.29 15.5 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.563 -1.273 . . . . 72.43 107.563 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.503 ' CD2' ' HG ' ' A' ' 76' ' ' LEU . 2.1 p80 -147.72 139.34 23.88 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.366 0.876 . . . . 64.33 113.366 -172.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.449 HD22 HD13 ' A' ' 112' ' ' ILE . 56.5 tp -116.72 116.48 27.6 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.155 -0.93 . . . . 73.44 108.762 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.534 HD11 ' CD2' ' A' ' 111' ' ' HIS . 16.3 tp -109.66 125.28 52.45 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.888 0.375 . . . . 73.44 110.967 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 p -123.92 136.12 61.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.626 -0.716 . . . . 61.23 109.85 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -84.71 179.7 7.3 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.457 0.646 . . . . 73.23 111.501 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -148.65 153.8 38.8 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.184 -0.917 . . . . 73.15 109.005 178.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.0 t -44.02 -51.82 7.53 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.997 0.81 . . . . 73.43 112.583 -176.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -90.08 65.31 6.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.092 0.473 . . . . 74.22 111.115 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -110.11 168.8 9.17 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.972 -0.558 . . . . 55.33 109.728 177.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -69.8 -24.92 63.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.159 0.504 . . . . 72.3 110.189 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -153.55 88.8 3.61 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.811 -0.632 . . . . 63.01 109.343 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.5 56.53 6.12 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 123.042 2.495 . . . . 61.43 112.546 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.5 m -137.33 125.23 22.66 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.303 -0.408 . . . . 73.11 110.344 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.5 m -127.4 176.79 7.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.761 0.315 . . . . 72.22 111.622 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -66.99 -31.14 71.51 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.452 0.538 . . . . 65.55 112.452 -178.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -86.61 -62.11 1.58 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.169 0.509 . . . . 73.42 109.791 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -112.35 127.61 56.05 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.809 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -82.01 -14.06 56.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.98 -0.555 . . . . 45.43 110.772 -178.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -123.58 139.44 54.0 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 65.13 109.429 176.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.09 102.26 13.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.958 0.408 . . . . 75.05 110.703 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.1 p -81.43 -41.6 21.61 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.943 -0.571 . . . . 61.12 110.301 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.5 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 8.4 ptt85 -53.09 117.54 3.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.504 -0.771 . . . . 74.12 111.964 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.3 t -82.37 -179.25 7.35 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.872 -0.604 . . . . 65.35 110.639 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -41.11 87.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 63.21 111.065 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.03 -45.47 94.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.421 -0.354 . . . . 74.13 111.051 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.506 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 47.5 mt-10 -65.69 -41.62 92.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.06 -0.518 . . . . 74.11 110.434 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.423 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -65.5 -35.77 81.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 72.03 111.148 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.63 -44.49 93.46 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.083 0.468 . . . . 74.5 109.815 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.84 -36.59 80.61 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.84 -0.618 . . . . 62.1 110.208 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.8 mt -62.2 -42.01 98.89 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.321 -0.4 . . . . 75.02 110.048 178.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 39' ' ' ALA . 31.6 mm -54.8 -54.43 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 116.224 -0.444 . . . . 74.02 110.201 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -60.66 -38.35 84.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.771 -0.65 . . . . 71.31 110.373 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -46.92 93.53 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.859 -0.61 . . . . 64.44 111.882 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.486 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.2 m-85 -61.39 -50.43 72.91 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.862 -0.422 . . . . 72.41 109.862 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.79 -48.94 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.816 -0.629 . . . . 52.31 111.165 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -39.61 89.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.257 -0.429 . . . . 70.13 111.27 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.465 ' HG3' ' OE1' ' A' ' 54' ' ' GLU . 41.9 tttp -67.27 -36.08 80.83 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 120.899 0.381 . . . . 64.31 110.73 -179.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.503 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 91.4 mt -65.28 -47.05 88.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.552 -0.536 . . . . 71.44 109.552 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.77 -15.01 63.39 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.703 -0.681 . . . . 72.23 111.538 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.4 m -80.04 -11.77 59.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.952 0.406 . . . . 72.05 110.411 177.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.16 18.38 74.57 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.788 -0.72 . . . . 65.21 112.01 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.465 ' OE1' ' HG3' ' A' ' 49' ' ' LYS . 48.1 mt-10 -88.9 -68.35 0.78 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.107 0.479 . . . . 74.51 109.811 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 73.8 mm-40 -108.37 147.52 31.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.767 -0.652 . . . . 73.11 109.903 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -93.71 157.52 16.12 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.183 -0.673 . . . . 53.23 109.183 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -36.29 63.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.002 0.43 . . . . 74.43 110.814 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -60.76 -34.81 75.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.736 -0.665 . . . . 72.54 111.093 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.7 t -69.19 -44.76 71.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.171 0.51 . . . . 73.15 109.974 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.81 -45.81 80.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.741 -0.663 . . . . 72.03 110.531 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.417 ' HA ' HD13 ' A' ' 14' ' ' LEU . . . -70.24 -17.8 63.14 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.892 0.701 . . . . 43.31 112.892 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.7 m -99.01 -24.2 15.0 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.719 0.637 . . . . 72.51 112.719 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -121.27 -28.3 4.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.136 0.791 . . . . 71.13 113.136 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -105.81 5.2 30.6 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.114 0.413 . . . . 74.44 112.114 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -90.97 140.63 29.66 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.654 -0.418 . . . . 71.45 109.946 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -88.8 -1.4 58.07 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.205 0.526 . . . . 64.42 110.559 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.441 ' HB2' HD22 ' A' ' 15' ' ' LEU . 46.9 t -87.5 154.57 20.53 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.956 -0.566 . . . . 53.3 110.474 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 m -74.87 -9.05 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.415 0.626 . . . . 74.31 109.882 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.9 p -74.2 -5.78 43.95 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.499 -0.773 . . . . 74.13 110.93 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -29.0 68.87 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.041 -0.527 . . . . 44.03 109.99 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -68.98 -26.63 65.12 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.539 -0.755 . . . . 64.12 110.3 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.54 16.06 5.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.165 -0.471 . . . . 61.51 110.298 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.0 ttt85 69.0 17.53 8.57 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.601 -0.727 . . . . 75.55 110.434 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.27 71.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.613 -0.721 . . . . 61.12 113.137 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -124.94 135.31 52.71 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 122.614 -0.345 . . . . 74.12 110.943 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.503 ' HG ' ' CD2' ' A' ' 13' ' ' HIS . 75.5 mt -91.35 -11.22 38.53 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 74.02 111.302 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.77 -158.18 49.73 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.405 -0.902 . . . . 33.33 110.908 -176.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.9 117.44 27.9 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.84 0.352 . . . . 73.41 110.505 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -118.06 166.49 12.48 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 109.664 -0.495 . . . . 73.1 109.664 178.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -96.23 170.8 9.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.047 0.451 . . . . 72.22 111.243 -177.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -69.93 132.04 45.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.604 -0.725 . . . . 72.35 110.919 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.42 39.79 25.18 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.918 -0.658 . . . . 70.23 112.126 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -123.62 -4.69 8.19 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.158 0.429 . . . . 74.01 112.158 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 35.4 tpp -125.89 173.96 8.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.666 -0.414 . . . . 70.43 111.29 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -54.55 145.33 18.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.475 -0.33 . . . . 75.11 110.789 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 27.2 tptp -48.39 -54.46 25.7 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 113.457 0.91 . . . . 71.32 113.457 -176.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 29.4 Cg_endo -62.41 -26.79 76.9 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.12 1.88 . . . . 74.45 112.761 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -84.8 -43.23 14.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.144 0.497 . . . . 73.52 109.706 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.5 -50.98 70.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.063 -0.971 . . . . 73.33 110.922 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.18 -48.61 77.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.644 -0.707 . . . . 65.53 111.558 -178.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.72 77.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.186 -0.461 . . . . 72.25 112.043 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.434 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 71.7 m -59.04 -50.82 72.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.776 0.322 . . . . 63.45 111.459 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -79.2 -16.55 56.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.543 -0.299 . . . . 74.04 111.677 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.44 62.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.159 0.504 . . . . 43.24 109.73 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.7 mt -84.71 -171.38 3.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.566 -0.743 . . . . 74.44 109.9 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -148.09 -178.88 6.53 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.178 -0.675 . . . . 75.13 109.178 177.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 116' ' ' THR . 32.5 m -54.53 113.04 1.14 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.595 0.358 . . . . 74.45 111.957 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 97.36 -6.56 63.45 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.935 -0.65 . . . . 61.04 113.621 175.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -90.99 149.7 21.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.146 0.498 . . . . 61.2 111.863 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.6 ttp -131.05 131.51 44.3 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.474 -0.785 . . . . 71.03 110.323 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.2 t -87.21 168.29 13.35 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.685 -0.487 . . . . 74.21 109.685 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.57 -137.28 5.86 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.804 -0.712 . . . . 73.43 112.532 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.21 108.95 2.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.728 2.285 . . . . 63.0 113.388 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 74.4 t -102.97 104.79 17.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.258 -0.645 . . . . 54.04 109.258 175.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -76.11 122.88 24.93 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.262 -0.426 . . . . 75.32 111.445 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.506 HG23 ' H ' ' A' ' 107' ' ' ASP . 0.6 OUTLIER -127.42 -152.77 0.53 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 116.137 -0.483 . . . . 61.44 109.99 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.506 ' H ' HG23 ' A' ' 106' ' ' THR . 8.7 m-20 -71.4 -65.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.947 0.351 . . . . 75.15 111.947 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 43.3 t -64.15 -42.92 96.58 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.113 -0.494 . . . . 72.35 111.729 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -179.28 -145.02 6.05 Favored Glycine 0 N--CA 1.436 -1.312 0 C-N-CA 120.179 -1.01 . . . . 70.25 112.512 -178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.8 mt -96.54 137.95 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 110.171 -0.307 . . . . 75.1 110.171 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.534 ' CD2' HD11 ' A' ' 15' ' ' LEU . 12.7 m-70 -119.59 130.64 55.22 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.396 -0.365 . . . . 65.45 110.826 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.449 HD13 HD22 ' A' ' 14' ' ' LEU . 24.6 mt -101.28 130.88 50.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 107.648 -1.242 . . . . 61.25 107.648 172.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.0 120.24 62.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 112.095 0.406 . . . . 74.54 112.095 -175.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.6 tp -112.84 109.53 19.06 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.971 -0.751 . . . . 73.23 108.971 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 92' ' ' SER . 80.0 ttt180 -85.39 114.87 22.77 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.584 -0.446 . . . . 73.23 110.793 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.499 ' O ' HG22 ' A' ' 97' ' ' THR . 6.9 m -84.16 -44.65 13.77 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.913 -0.585 . . . . 73.44 110.425 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 . . . . . 0 C--O 1.243 0.726 0 CA-C-O 118.38 -0.819 . . . . 74.42 110.512 -178.36 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.487 -0.645 . . . . 44.34 111.487 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.5 m -64.85 -30.11 71.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.053 0.454 . . . . 71.42 110.301 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -102.95 154.06 19.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.36 -0.607 . . . . 75.42 109.36 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -102.35 153.11 20.32 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.862 -0.422 . . . . 63.4 109.862 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -81.26 118.46 72.4 Favored Pre-proline 0 C--N 1.309 -1.162 0 N-CA-C 108.83 -0.804 . . . . 63.21 108.83 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -57.7 134.03 60.3 Favored 'Trans proline' 0 N--CA 1.466 -0.102 0 C-N-CA 122.865 2.377 . . . . 62.55 112.59 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.46 -26.3 58.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.951 -0.568 . . . . 54.23 109.571 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -125.73 113.42 17.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 73.43 109.418 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.8 m -111.83 148.4 15.04 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 116.386 -0.37 . . . . 54.03 110.901 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -126.18 129.15 48.44 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.289 -0.414 . . . . 75.5 110.103 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.434 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 61.7 m -138.9 155.57 47.97 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.754 -0.657 . . . . 64.44 110.345 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.2 m -98.35 142.48 29.93 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.973 -1.121 . . . . 74.41 107.973 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.408 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 1.3 p80 -127.24 129.99 48.79 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.887 0.699 . . . . 71.32 112.887 -175.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.43 ' HB3' ' HB ' ' A' ' 112' ' ' ILE . 2.9 tm? -105.71 127.32 53.01 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 106.491 -1.67 . . . . 63.25 106.491 175.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 108' ' ' SER . 38.3 tp -125.56 121.08 32.62 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.641 -0.424 . . . . 72.55 111.286 -178.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -137.18 130.81 44.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.507 -0.769 . . . . 65.01 109.729 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 51.0 mttp -97.16 -179.97 4.71 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.165 -0.471 . . . . 75.44 111.206 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.43 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 3.4 p80 -153.5 -179.26 7.6 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.447 -0.575 . . . . 72.04 109.447 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 p -48.13 -46.15 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.598 0.561 . . . . 75.14 111.843 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.43 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 78.5 mm-40 -85.34 69.1 10.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.113 0.483 . . . . 75.03 111.51 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.9 t -144.99 157.78 44.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.068 -0.716 . . . . 71.24 109.068 176.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.88 -19.54 60.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.94 0.4 . . . . 75.44 111.308 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -123.78 94.94 45.28 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.31 -0.404 . . . . 75.24 110.321 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -91.53 28.4 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 123.083 2.522 . . . . 60.33 112.67 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -143.27 128.93 19.23 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.407 -0.36 . . . . 61.23 110.336 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.37 -168.72 1.85 Allowed 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.098 -0.334 . . . . 74.42 110.098 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 66.8 p-90 -86.26 -16.65 36.94 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.026 0.441 . . . . 73.11 110.006 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -100.41 -37.95 8.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 71.31 110.809 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -131.94 117.36 18.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.489 -0.56 . . . . 71.21 109.489 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 63.23 111.888 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -134.24 101.18 4.92 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.045 0.45 . . . . 62.41 110.509 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.18 93.17 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.993 -0.549 . . . . 73.13 110.173 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.9 p -88.8 -16.88 30.98 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.049 -0.523 . . . . 74.43 111.608 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -67.16 124.82 24.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.264 0.554 . . . . 71.31 111.815 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.2 t -84.28 -177.53 6.67 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.72 -0.673 . . . . 60.33 110.923 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -57.82 -42.02 83.44 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 122.794 0.438 . . . . 73.43 111.021 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -57.67 -44.17 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.1 111.328 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 27.1 mm-40 -69.7 -42.16 74.44 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.878 -0.601 . . . . 70.53 110.449 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.01 -44.24 97.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.662 -0.699 . . . . 72.24 111.482 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -58.47 -45.47 88.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.538 -0.301 . . . . 61.32 111.609 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -61.44 -34.02 74.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.894 0.378 . . . . 75.22 110.816 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.9 mt -72.29 -41.81 66.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.015 -0.539 . . . . 74.41 110.019 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.0 mm -58.65 -47.07 89.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.135 -0.484 . . . . 74.02 109.815 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.539 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 85.8 m-20 -57.48 -43.65 84.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 115.723 -0.672 . . . . 75.11 109.927 178.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.6 -41.28 97.24 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.722 -0.672 . . . . 74.23 112.243 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -61.94 -48.83 78.67 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 109.518 -0.549 . . . . 71.53 109.518 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.83 -42.96 87.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.368 -0.833 . . . . 74.11 110.702 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.539 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 81.3 mm-40 -58.52 -48.06 82.1 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 116.299 -0.41 . . . . 73.41 110.902 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -59.54 -41.78 90.83 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.894 0.331 . . . . 72.12 111.894 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 71.9 mt -72.22 -41.47 66.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 74.12 111.844 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -78.11 -40.07 39.37 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 72.03 112.373 -178.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.0 t -73.97 -26.3 60.4 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.596 0.236 . . . . 74.21 110.878 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.44 38.54 5.58 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.573 -0.822 . . . . 54.21 112.074 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.69 -49.55 7.07 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 72.1 110.226 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -143.38 173.7 11.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.787 -0.642 . . . . 72.2 110.305 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -99.15 153.97 18.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.136 -0.484 . . . . 71.5 110.215 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -55.52 -38.16 68.86 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.005 0.431 . . . . 64.2 110.264 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.498 ' OE2' ' HD2' ' A' ' 73' ' ' ARG . 35.5 mt-10 -61.68 -30.67 70.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.644 -0.707 . . . . 72.45 111.283 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.8 t -76.67 -28.93 56.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.347 0.594 . . . . 74.51 110.453 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -87.84 -47.94 8.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.781 -0.645 . . . . 64.31 111.081 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -19.98 64.03 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.925 0.713 . . . . 71.12 112.925 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.689 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 2.7 p -76.65 -20.79 56.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.196 0.813 . . . . 72.32 113.196 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -128.77 -22.53 3.24 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.931 0.715 . . . . 74.52 112.931 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -91.56 -10.85 39.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.658 0.614 . . . . 72.42 112.658 -177.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.414 ' OG ' HD23 ' A' ' 14' ' ' LEU . 34.3 m -84.41 136.21 33.96 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.998 -0.281 . . . . 63.22 110.244 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -84.96 -11.8 54.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.306 0.574 . . . . 53.02 109.913 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.424 ' HB2' HD22 ' A' ' 15' ' ' LEU . 30.9 t -79.6 159.7 26.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.317 -0.856 . . . . 74.02 110.89 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 17.0 m -70.05 -19.0 63.31 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.161 -0.472 . . . . 64.55 110.138 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.9 m -67.67 -5.03 13.87 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.969 -0.56 . . . . 73.33 111.421 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.689 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -51.99 -51.15 59.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.185 -0.461 . . . . 74.32 111.285 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.88 4.44 9.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.116 0.413 . . . . 64.05 112.116 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.3 12.34 37.33 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.964 -0.754 . . . . 71.32 108.964 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.498 ' HD2' ' OE2' ' A' ' 58' ' ' GLU . 75.9 mtm180 69.33 16.4 8.36 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.791 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.49 3.43 90.53 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.002 -0.618 . . . . 70.42 113.316 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -73.72 134.6 43.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.085 0.469 . . . . 71.43 111.025 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.526 HD22 ' O ' ' A' ' 76' ' ' LEU . 4.1 tt -101.69 -19.64 15.32 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.782 -0.821 . . . . 75.03 108.782 178.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.44 -176.38 48.2 Favored Glycine 0 N--CA 1.437 -1.272 0 CA-C-N 115.56 -0.745 . . . . 63.13 111.628 -178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.04 131.98 34.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 120.748 0.309 . . . . 75.2 110.235 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -133.27 154.44 50.68 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.913 -0.585 . . . . 74.53 110.02 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 p -95.56 -80.85 0.41 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 111.989 0.366 . . . . 72.31 111.989 -177.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -161.64 136.97 7.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 72.31 110.842 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.57 15.93 76.87 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.748 -0.66 . . . . 74.31 111.474 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -103.87 -36.38 7.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 72.41 110.824 -176.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' MET . . . . . 0.411 ' HE2' HD13 ' A' ' 76' ' ' LEU . 26.5 tpp -121.23 157.56 30.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.205 -0.452 . . . . 72.13 109.996 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -48.03 135.7 12.43 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 123.38 0.425 . . . . 73.41 111.464 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.496 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 12.7 tmtt? -48.6 -52.48 44.11 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 115.64 -0.709 . . . . 50.24 112.635 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.1 Cg_endo -53.54 -24.14 27.78 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.619 2.212 . . . . 72.31 113.413 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.561 ' CD2' HG12 ' A' ' 113' ' ' ILE . 31.1 t80 -99.42 -53.36 3.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.056 0.455 . . . . 74.32 110.586 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -59.86 -48.08 83.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.52 -0.764 . . . . 65.45 111.386 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -60.76 -45.09 95.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.115 -0.493 . . . . 73.42 111.683 -178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.92 66.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 63.42 111.351 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.434 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 67.5 m -65.84 -24.16 66.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.237 -0.438 . . . . 64.32 111.668 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -81.84 -27.51 33.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.412 . . . . 73.02 110.542 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.61 -28.08 37.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.863 -0.608 . . . . 73.45 110.887 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 94.8 mt -82.68 133.22 35.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.067 -0.515 . . . . 74.12 110.546 179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -97.09 169.41 9.83 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.322 -0.399 . . . . 71.45 109.97 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.9 m -55.89 111.28 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.302 -0.408 . . . . 62.04 111.158 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.31 -13.28 23.54 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.692 -0.766 . . . . 42.21 112.691 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -91.0 154.63 19.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.908 0.385 . . . . 72.2 110.958 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.8 ttp -142.23 130.23 21.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.127 -0.488 . . . . 74.11 110.427 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.0 t -78.86 157.46 28.32 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.075 -0.512 . . . . 73.4 110.321 179.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.18 -155.88 22.78 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.811 -0.709 . . . . 72.1 111.776 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.02 105.73 1.41 Allowed 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.636 2.224 . . . . 74.44 113.232 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.2 110.8 21.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.921 -0.77 . . . . 74.24 108.921 175.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -83.92 122.47 28.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.214 -0.448 . . . . 75.33 111.937 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.5 p -142.45 178.57 7.51 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.793 -0.639 . . . . 73.55 109.779 178.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.21 -31.98 70.94 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.036 0.446 . . . . 73.55 110.865 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.514 ' O ' HD13 ' A' ' 15' ' ' LEU . 11.8 p -79.74 4.97 14.66 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.63 -0.713 . . . . 75.24 111.33 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.85 -158.44 14.28 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.845 -0.693 . . . . 70.01 112.389 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.4 mt -97.93 128.12 49.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 N-CA-C 109.837 -0.431 . . . . 74.23 109.837 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -110.9 125.54 53.76 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.496 -0.32 . . . . 75.24 110.812 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' A' ' 14' ' ' LEU . 59.0 mt -102.17 130.67 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.458 -0.942 . . . . 74.05 108.458 174.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' CD2' ' A' ' 88' ' ' PHE . 11.0 mt -110.79 107.43 22.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.652 -0.249 . . . . 73.01 111.202 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.9 tt -104.75 114.81 29.25 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.174 -0.676 . . . . 71.44 109.174 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -79.39 108.39 12.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.222 -0.444 . . . . 71.51 110.261 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.2 p -95.07 -64.07 1.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.644 0.979 . . . . 75.53 113.644 -176.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.344 -0.836 . . . . 74.42 111.765 -174.901 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 112.216 -0.354 . . . . 44.14 112.216 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.1 t -62.78 112.48 2.55 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 122.489 0.316 . . . . 72.24 110.322 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -71.43 144.11 49.87 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.811 -0.356 . . . . 74.31 110.265 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.02 175.73 10.12 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.073 -0.512 . . . . 64.4 110.025 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -91.53 107.57 22.92 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.559 -0.904 . . . . 53.3 108.559 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.77 139.37 33.5 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.564 2.176 . . . . 73.35 112.669 -176.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.07 -16.63 37.48 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.292 0.568 . . . . 70.34 109.877 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.466 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.6 mtt180 -107.07 117.51 34.26 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.257 -0.883 . . . . 74.24 110.021 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.3 m -124.54 148.66 28.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 CA-C-N 116.165 -0.471 . . . . 73.24 110.366 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.426 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.4 ttt180 -103.54 109.06 20.58 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 110.043 -0.355 . . . . 70.12 110.043 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.468 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 84.8 m -128.88 132.78 47.74 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.299 0.571 . . . . 74.14 111.318 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.8 m -98.1 142.77 29.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 108.247 -1.02 . . . . 73.02 108.247 176.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.485 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -133.91 129.06 35.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.452 0.908 . . . . 72.31 113.452 -176.58 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.4 tt -106.78 142.61 36.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 107.645 -1.243 . . . . 75.24 107.645 174.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.479 HD22 ' HB2' ' A' ' 67' ' ' SER . 46.0 tp -123.75 134.05 53.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.883 0.327 . . . . 75.53 111.883 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.412 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 14.4 p -117.64 132.62 66.93 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-N 115.758 -0.655 . . . . 70.13 109.944 175.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.89 158.24 16.88 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.956 0.408 . . . . 73.34 110.171 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -139.98 158.25 44.36 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.11 -0.496 . . . . 75.12 109.735 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.2 t -43.76 -59.88 2.04 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.98 0.8 . . . . 74.43 112.356 -177.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -92.02 66.84 5.04 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.053 0.454 . . . . 71.34 111.12 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 t -116.0 173.74 6.41 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.067 -0.515 . . . . 75.1 109.621 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -56.51 -57.21 13.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 53.3 109.879 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -126.55 97.96 32.69 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 109.37 -0.604 . . . . 75.43 109.37 175.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -73.73 50.57 2.09 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.387 2.725 . . . . 62.5 112.295 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -140.82 152.39 45.13 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 116.038 -0.528 . . . . 53.22 110.172 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.3 p -154.99 -176.4 5.92 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.358 -0.608 . . . . 60.35 109.358 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -82.64 -3.38 56.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.352 0.596 . . . . 72.33 109.589 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.441 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 58.9 mtp180 -104.99 -43.64 5.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.791 . . . . 74.22 110.078 -178.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.414 ' HB3' HD13 ' A' ' 32' ' ' ILE . 62.8 tt0 -142.92 118.34 10.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.866 -0.606 . . . . 74.23 109.894 -178.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.36 -29.27 63.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.926 0.393 . . . . 70.25 111.164 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -123.1 94.11 4.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.232 0.539 . . . . 74.52 110.241 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.414 HD13 ' HB3' ' A' ' 29' ' ' GLN . 42.6 mm -68.73 104.01 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.501 -0.772 . . . . 63.45 111.39 -178.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.54 -24.07 20.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.044 -0.525 . . . . 74.21 111.001 177.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 ptt180 -60.64 118.22 6.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.898 -0.592 . . . . 75.4 110.303 177.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t -85.15 -174.72 5.4 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.767 -0.651 . . . . 74.53 112.098 -175.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -57.58 -50.62 72.52 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.559 -0.746 . . . . 70.02 111.482 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -52.2 -44.01 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.207 -0.451 . . . . 65.55 111.295 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 38.8 mt-10 -67.55 -51.14 54.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.9 -0.591 . . . . 72.14 110.694 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.1 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.02 -0.536 . . . . 53.13 111.145 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.0 tp -61.93 -44.3 97.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 75.05 110.722 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -70.27 -33.82 72.04 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.416 -0.356 . . . . 71.15 111.097 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.6 mt -62.3 -48.35 80.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.988 -0.375 . . . . 72.21 109.988 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.445 HG21 HG12 ' A' ' 112' ' ' ILE . 29.6 mm -54.08 -60.49 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-N 115.772 -0.649 . . . . 73.23 111.302 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -63.8 -28.91 70.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 74.21 111.0 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.483 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -64.43 -54.72 27.58 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 111.609 -0.597 . . . . 70.22 111.609 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.463 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.3 m-85 -56.73 -45.15 82.13 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.005 -0.368 . . . . 72.23 110.005 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.456 ' CD1' ' HA2' ' A' ' 102' ' ' GLY . 78.6 mt -54.98 -47.76 76.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.798 -0.637 . . . . 72.34 110.843 178.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -64.61 -40.13 94.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 63.41 110.756 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.3 mtpp -64.39 -39.83 94.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.96 0.409 . . . . 74.2 110.692 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 46' ' ' TYR . 88.4 mt -68.87 -46.91 78.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.637 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -62.17 -29.08 70.11 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.307 -0.406 . . . . 72.54 112.04 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 m -77.41 -9.04 58.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.828 0.347 . . . . 72.12 110.76 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 3.33 83.35 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.002 -0.618 . . . . 75.33 112.288 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -73.78 -62.54 1.46 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.992 0.425 . . . . 63.43 110.783 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -101.92 167.15 10.24 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.066 -0.516 . . . . 72.11 110.682 -178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -119.66 140.41 50.67 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.531 -0.544 . . . . 53.51 109.531 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -57.32 -55.6 32.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.8 0.296 . . . . 75.02 111.8 -177.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -53.14 -42.52 66.16 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.686 0.279 . . . . 75.31 111.351 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.6 m -64.39 -47.28 79.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.294 -0.412 . . . . 72.35 110.93 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.89 -43.29 79.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 74.12 111.016 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.611 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -68.53 -10.85 58.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.142 -0.481 . . . . 75.22 112.273 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 70.5 m -88.38 -13.19 41.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.775 0.322 . . . . 75.45 111.267 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -128.62 -36.41 1.85 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.7 0.63 . . . . 64.52 112.7 -177.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.81 9.1 38.59 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.4 0.518 . . . . 74.52 112.4 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -92.09 114.45 26.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.708 -0.397 . . . . 72.05 110.06 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.441 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 59.5 m-20 -78.76 51.3 1.08 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.256 0.55 . . . . 61.35 110.781 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.479 ' HB2' HD22 ' A' ' 15' ' ' LEU . 26.0 t -164.61 178.19 7.51 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.676 -0.693 . . . . 71.24 109.355 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -67.06 -14.06 62.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.97 0.414 . . . . 51.43 110.713 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.5 m -56.11 -24.77 42.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.738 -0.665 . . . . 75.01 111.024 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.611 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -61.11 -30.29 70.27 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.923 -0.58 . . . . 62.35 111.725 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -83.44 -11.46 57.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.063 0.459 . . . . 71.11 111.043 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.48 13.81 18.94 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.205 -0.452 . . . . 70.44 111.248 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 64.03 11.19 5.94 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.305 -0.407 . . . . 75.24 111.724 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.402 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.39 -25.08 3.35 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 121.053 -0.594 . . . . 62.45 112.606 -178.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -77.91 126.61 31.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.063 0.459 . . . . 75.22 111.421 -178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -103.42 -4.75 23.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.726 -0.67 . . . . 74.4 110.776 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.426 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 78.13 -165.32 51.96 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.194 -1.003 . . . . 70.35 110.924 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.22 119.26 22.75 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.877 -0.416 . . . . 72.31 109.877 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.466 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 29.4 p90 -127.4 162.7 25.7 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.229 -0.442 . . . . 72.52 110.83 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.9 t -82.94 135.63 34.83 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.93 -0.577 . . . . 73.31 109.816 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -57.35 -31.49 65.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.898 -0.592 . . . . 74.02 111.939 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.82 73.1 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.662 -0.78 . . . . 53.05 112.222 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.6 16.37 17.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.957 0.408 . . . . 71.54 109.966 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.2 tpp -130.39 154.18 47.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.04 -0.527 . . . . 73.43 110.635 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 16.0 mm-40 -60.46 144.26 51.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.529 -0.305 . . . . 62.32 110.566 179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.472 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 48.2 tptt -59.46 -50.4 87.43 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 113.093 0.775 . . . . 74.55 113.093 -176.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 16.9 Cg_endo -58.76 -35.43 98.64 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 121.79 1.66 . . . . 75.21 111.445 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -68.57 -44.37 74.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.582 -0.736 . . . . 73.43 109.174 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.46 -48.59 80.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.605 -0.725 . . . . 71.4 110.158 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -55.58 -42.77 75.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.503 -0.771 . . . . 63.04 111.4 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.432 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -70.99 -40.7 71.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.327 -0.397 . . . . 71.15 110.91 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.468 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 52.9 m -62.87 -45.22 93.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.039 0.447 . . . . 73.43 111.328 -179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -78.65 -6.24 55.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.098 -0.501 . . . . 74.51 111.587 -178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.67 -26.3 21.92 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.252 -0.647 . . . . 74.32 109.252 175.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 91.0 mt -86.43 179.71 6.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.195 -0.911 . . . . 73.33 110.787 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -130.21 176.65 7.93 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.548 -0.751 . . . . 74.24 109.542 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.4 m -61.05 110.16 1.28 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.012 0.434 . . . . 64.45 111.035 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.39 16.22 32.74 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 121.023 -0.608 . . . . 55.41 112.502 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -109.72 148.17 31.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.849 0.357 . . . . 72.44 111.237 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' MET . . . . . 0.438 ' HE2' HG21 ' A' ' 47' ' ' ILE . 40.3 ttp -128.63 127.96 43.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.027 -0.533 . . . . 65.04 110.473 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.417 ' HB2' HD13 ' A' ' 95' ' ' LEU . 32.1 t -83.05 161.42 21.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.031 -0.531 . . . . 63.25 110.823 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.456 ' HA2' ' CD1' ' A' ' 47' ' ' ILE . . . -84.98 -139.02 4.47 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 115.938 -0.574 . . . . 44.23 112.405 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.58 106.15 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.821 2.347 . . . . 72.11 112.665 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.96 123.24 67.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.483 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -97.12 124.75 41.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.2 -0.455 . . . . 73.34 109.872 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.2 p -113.5 -60.56 1.87 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.364 0.505 . . . . 61.45 112.364 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -144.57 -53.01 0.31 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.382 0.512 . . . . 71.31 112.382 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 m -113.53 -53.67 2.67 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.944 0.35 . . . . 74.23 111.944 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.38 -169.38 12.61 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 119.973 -1.108 . . . . 63.05 112.733 -177.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.7 mt -90.78 138.49 19.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.501 -0.555 . . . . 73.13 109.501 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 72.9 m-70 -119.89 145.31 46.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.765 0.317 . . . . 73.01 111.373 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 50.0 mt -100.95 117.35 46.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.469 -1.308 . . . . 74.11 107.469 173.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 62.6 mt -103.72 110.9 31.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 120.92 0.39 . . . . 73.51 111.724 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.8 tp -106.09 107.4 18.38 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.815 -0.63 . . . . 72.43 109.842 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -85.19 100.22 11.61 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.686 -0.487 . . . . 74.13 109.686 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.2 m -74.15 -38.18 63.8 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.686 -0.688 . . . . 74.24 110.56 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.257 1.447 0 CA-C-O 118.518 -0.753 . . . . 73.21 110.318 -178.714 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.021 -0.432 . . . . 45.03 112.021 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -79.26 159.45 27.26 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.128 -0.323 . . . . 64.5 110.128 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -68.19 -39.53 82.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 109.63 -0.508 . . . . 75.42 109.63 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.4 ttp -96.43 88.56 4.76 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.216 -1.031 . . . . 62.34 108.216 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -126.3 118.49 23.35 Favored Pre-proline 0 C--N 1.312 -1.022 0 CA-C-N 116.018 -0.537 . . . . 72.53 110.679 -176.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.55 133.2 50.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.775 2.317 . . . . 74.22 111.895 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.27 -24.73 25.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.89 -0.596 . . . . 63.34 110.214 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -113.24 127.04 56.04 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.602 -0.727 . . . . 72.02 109.784 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.1 m -125.58 143.65 38.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 CA-C-N 116.263 -0.426 . . . . 72.34 110.514 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -112.27 122.92 49.08 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.623 -0.51 . . . . 74.13 109.623 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.501 ' HG ' ' CB ' ' A' ' 92' ' ' SER . 69.5 m -134.53 167.64 20.42 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.101 0.476 . . . . 52.53 111.049 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -122.37 145.33 48.37 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.486 -0.931 . . . . 73.32 108.486 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.427 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.6 p80 -124.06 129.44 50.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.448 -0.501 . . . . 74.14 112.304 -176.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.485 ' CD1' ' HA ' ' A' ' 61' ' ' ALA . 38.4 tp -106.2 119.11 38.37 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 108.506 -0.924 . . . . 74.22 108.506 176.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.61 HD11 ' NE2' ' A' ' 111' ' ' HIS . 13.8 tp -116.84 120.17 37.68 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.15 0.5 . . . . 63.02 111.326 -178.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.7 t -118.47 105.92 18.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.0 -1.0 . . . . 74.14 108.312 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -76.48 168.85 19.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.497 0.665 . . . . 73.2 111.803 -177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.427 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 2.0 p80 -139.26 156.26 47.19 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.134 -0.939 . . . . 72.4 109.828 -178.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.418 ' C ' ' H ' ' A' ' 21' ' ' SER . 8.7 p -51.34 -38.02 50.93 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 123.834 0.709 . . . . 72.32 112.059 -178.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -74.05 29.96 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.659 0.614 . . . . 73.41 112.659 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.418 ' H ' ' C ' ' A' ' 19' ' ' SER . 22.4 t -113.16 179.42 3.97 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.972 -0.751 . . . . 75.32 108.972 177.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.41 HH12 ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -83.27 -29.4 28.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.933 0.397 . . . . 71.34 110.364 -179.733 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -111.19 102.0 51.79 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.098 -0.501 . . . . 74.21 110.43 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.44 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 66.1 Cg_endo -92.03 34.26 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.998 2.465 . . . . 74.13 111.712 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.5 p -149.76 158.07 43.82 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.925 0.393 . . . . 74.43 111.054 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.9 p -148.27 -161.6 1.37 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 72.41 109.667 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 70.2 p-90 -89.76 -5.58 56.82 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.916 0.389 . . . . 75.21 110.584 178.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -130.71 0.13 4.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.255 -0.43 . . . . 63.33 111.73 -177.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -148.36 128.72 13.88 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.697 -0.483 . . . . 70.43 109.697 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.7 -31.34 32.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.495 -0.321 . . . . 75.14 111.068 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 20.9 ptmt -140.57 106.93 5.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.391 0.615 . . . . 73.55 111.551 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.6 mm -67.79 102.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.825 -0.805 . . . . 63.05 108.825 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 m -97.68 -11.44 23.5 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.92 -0.582 . . . . 70.24 110.674 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -74.7 129.41 37.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.021 -0.536 . . . . 74.1 110.287 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.468 HG23 ' OE1' ' A' ' 38' ' ' GLU . 9.0 t -87.24 -178.66 6.26 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 120.759 -0.376 . . . . 62.34 110.027 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -62.87 -44.46 96.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.841 -0.163 . . . . 61.32 111.426 -177.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.7 mp0 -57.04 -44.18 82.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.416 -0.356 . . . . 72.12 110.567 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.468 ' OE1' HG23 ' A' ' 35' ' ' THR . 42.1 mt-10 -66.97 -43.87 81.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.847 -0.615 . . . . 55.34 110.727 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.554 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.49 -41.21 98.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.015 -0.539 . . . . 74.12 110.584 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.86 -42.1 92.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.903 -0.59 . . . . 75.21 110.05 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 50.3 mm-40 -58.39 -41.57 85.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 73.13 110.474 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.04 -40.73 87.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.856 -0.611 . . . . 52.12 110.036 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.554 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.5 mm -53.55 -49.47 55.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.674 -0.694 . . . . 61.11 111.066 179.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -55.23 -47.07 75.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.162 0.506 . . . . 73.33 110.191 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.462 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -57.33 -47.29 89.04 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.437 -0.801 . . . . 51.23 112.257 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.468 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.3 m-85 -59.94 -52.3 66.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.347 0.118 . . . . 74.1 110.948 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -56.22 -45.95 81.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.023 0.439 . . . . 75.32 110.705 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -66.21 -42.01 89.35 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.887 -0.597 . . . . 75.41 112.142 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.462 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 30.0 mtpp -63.58 -37.98 89.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.621 0.248 . . . . 64.15 111.491 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 46' ' ' TYR . 79.0 mt -66.33 -48.16 81.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.39 -0.368 . . . . 55.43 110.718 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -69.98 -18.49 63.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.345 -0.389 . . . . 63.5 111.924 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -91.12 1.05 57.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.912 0.387 . . . . 71.23 110.741 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.08 30.27 69.98 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.999 -0.546 . . . . 75.12 113.363 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -92.11 -53.13 4.38 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.506 -0.408 . . . . 72.32 110.655 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -137.1 148.02 46.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.08 -0.509 . . . . 74.21 110.077 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -81.89 160.82 23.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.093 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -62.81 -53.9 47.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.935 -0.575 . . . . 75.03 110.582 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.471 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 2.8 mp0 -58.45 -31.24 67.6 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 72.13 110.509 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 29.7 t -67.23 -52.07 45.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.758 -0.656 . . . . 73.4 109.652 178.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.24 -33.88 76.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.398 -0.365 . . . . 73.41 110.858 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.485 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -63.89 -32.44 73.96 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.033 -0.53 . . . . 75.03 111.46 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -95.76 5.72 50.68 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.987 0.423 . . . . 75.53 111.225 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 59' ' ' SER . 27.8 mt-30 -115.43 -53.96 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.193 0.442 . . . . 64.13 112.193 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -108.88 -6.76 15.64 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.661 0.986 . . . . 43.54 113.661 -173.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -78.83 136.92 37.47 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.022 -0.671 . . . . 62.55 110.599 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -95.63 11.61 32.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.847 -0.615 . . . . 75.33 110.367 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.507 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 48.3 t -81.81 145.2 30.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.699 -0.682 . . . . 63.44 110.146 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 p -62.4 -26.3 68.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.073 0.463 . . . . 71.0 110.983 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 m -74.94 -4.99 41.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.73 -0.668 . . . . 65.45 111.81 -178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.06 65.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.815 0.34 . . . . 71.43 111.187 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -32.63 74.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.231 0.539 . . . . 74.33 110.624 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.33 16.36 11.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.849 -0.614 . . . . 73.42 110.19 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.471 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 12.3 mpt_? 67.45 14.16 9.54 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.402 -0.817 . . . . 73.35 111.94 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.427 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.35 7.65 88.34 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.738 -0.744 . . . . 44.02 112.806 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -80.02 136.95 36.7 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.828 0.347 . . . . 61.23 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 mp -101.49 -21.2 14.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.161 -0.472 . . . . 43.2 110.109 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.96 -171.04 42.3 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.772 -0.931 . . . . 42.01 110.772 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.05 107.93 10.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 117.187 0.494 . . . . 64.24 110.182 179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.0 p90 -123.59 -174.37 2.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.192 -0.458 . . . . 74.55 110.756 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -148.87 -165.89 2.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.247 -0.649 . . . . 72.01 109.247 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -66.63 134.43 52.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.033 0.444 . . . . 73.53 111.769 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.451 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 102.91 22.91 8.97 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.878 -0.601 . . . . 61.34 112.375 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -122.99 -34.81 3.11 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.33 0.493 . . . . 54.51 112.33 -177.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.1 tpp -135.73 171.33 14.61 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.812 -0.355 . . . . 60.44 111.207 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -55.58 141.61 36.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.315 -0.402 . . . . 72.42 110.273 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -51.96 -48.57 87.76 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.195 0.813 . . . . 71.02 113.195 -176.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -51.51 -28.79 29.53 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.209 1.939 . . . . 71.44 113.03 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.505 ' CD2' HG12 ' A' ' 113' ' ' ILE . 48.1 t80 -95.48 -49.88 5.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.324 0.583 . . . . 74.45 110.387 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 34.7 tt0 -61.21 -50.22 73.96 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.324 -0.853 . . . . 63.13 111.557 -176.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.48 -39.64 95.0 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.899 0.381 . . . . 65.1 111.05 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.61 -32.26 73.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.863 -0.608 . . . . 64.43 111.231 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.501 ' CB ' ' HG ' ' A' ' 11' ' ' CYS . 67.5 m -60.19 -31.77 70.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.177 -0.465 . . . . 72.31 111.294 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -86.81 -19.49 28.93 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.26 -0.427 . . . . 74.22 110.526 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.93 -42.93 15.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 74.13 111.395 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 69.8 mt -81.79 145.08 30.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.058 -0.519 . . . . 74.25 110.334 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.488 ' CG ' ' HG2' ' A' ' 99' ' ' GLU . 28.7 ptt180 -80.66 176.9 9.39 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.814 -0.439 . . . . 74.44 109.814 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -66.71 114.43 5.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.131 -0.486 . . . . 62.21 110.821 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.39 6.8 38.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.504 -0.855 . . . . 61.11 113.814 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.488 ' HG2' ' CG ' ' A' ' 96' ' ' ARG . 63.1 mm-40 -88.32 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.387 0.594 . . . . 73.13 111.905 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.9 tpp -104.44 128.47 52.34 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.163 -0.926 . . . . 74.01 109.261 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.415 ' CB ' ' HB ' ' A' ' 113' ' ' ILE . 32.8 t -91.74 156.37 17.61 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 116.454 -0.339 . . . . 75.32 110.223 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.65 -168.2 38.46 Favored Glycine 0 N--CA 1.44 -1.059 0 C-N-CA 120.754 -0.736 . . . . 41.43 111.525 178.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -66.13 102.46 0.56 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.78 2.32 . . . . 75.31 112.35 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.3 110.95 24.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 61.35 109.675 178.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -78.08 110.87 13.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.018 -0.537 . . . . 72.55 111.004 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 m -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.891 -0.781 . . . . 74.13 108.891 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.41 ' HB2' HH12 ' A' ' 22' ' ' ARG . 7.1 p-10 -60.1 -32.63 71.16 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.082 0.401 . . . . 74.31 112.082 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 p -79.36 -35.58 40.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.1 0.476 . . . . 54.22 111.602 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.427 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . 167.97 -162.88 36.68 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 110.863 -0.895 . . . . 72.4 110.863 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 31.8 mt -87.64 131.75 34.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 109.782 -0.451 . . . . 74.21 109.782 -179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.61 ' NE2' HD11 ' A' ' 15' ' ' LEU . 14.3 m-70 -121.47 139.65 53.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.282 -0.417 . . . . 74.31 111.163 -178.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.411 HD13 HD22 ' A' ' 14' ' ' LEU . 21.9 mt -109.34 139.5 31.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.15 -1.056 . . . . 74.12 108.15 173.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.505 HG12 ' CD2' ' A' ' 88' ' ' PHE . 23.5 mt -114.68 129.55 70.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 120.744 0.306 . . . . 53.31 111.606 -175.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -133.2 119.58 20.05 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.484 -0.561 . . . . 63.1 109.484 174.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -84.2 108.26 16.99 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.99 0.424 . . . . 65.22 109.938 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 m -70.18 -51.96 27.09 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.626 -0.715 . . . . 62.12 110.241 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.39 -0.814 . . . . 75.44 109.51 179.685 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.443 0 N-CA-C 111.709 -0.556 . . . . 75.41 111.709 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 p -64.42 -50.14 68.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.201 0.525 . . . . 64.33 110.792 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -114.17 98.18 6.8 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 75.22 110.326 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.5 ttm -130.42 115.0 16.25 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.841 -0.618 . . . . 74.33 110.463 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -63.69 141.92 97.97 Favored Pre-proline 0 C--N 1.313 -0.991 0 CA-C-N 115.618 -0.719 . . . . 74.41 110.305 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.32 133.45 43.4 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.682 2.255 . . . . 63.44 111.846 179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.64 -47.94 68.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.885 0.374 . . . . 62.45 110.625 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -109.97 96.12 6.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.453 -0.573 . . . . 73.0 109.453 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.2 p -109.92 145.33 16.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 116.205 -0.452 . . . . 51.31 110.793 -177.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -109.74 120.44 42.49 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.237 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -134.3 154.47 51.3 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.946 -0.57 . . . . 75.24 110.403 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 m -98.37 149.26 22.83 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.255 -1.017 . . . . 63.53 108.255 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.554 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -148.06 136.96 21.89 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.283 0.564 . . . . 74.21 112.51 -176.677 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.551 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.5 tt -106.98 140.77 39.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.271 -0.877 . . . . 70.42 108.817 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -132.91 127.08 33.54 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 110.054 -0.35 . . . . 75.24 110.054 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -122.27 127.83 75.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.018 0.437 . . . . 71.41 110.173 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -91.82 171.8 8.9 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.236 0.541 . . . . 52.41 111.032 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -152.37 163.03 40.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.87 -0.604 . . . . 73.13 109.848 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.8 t -54.64 -41.63 70.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.253 0.549 . . . . 74.35 110.189 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.01 62.31 6.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.873 -0.603 . . . . 74.1 110.113 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.0 t -135.17 165.17 26.01 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.458 -0.571 . . . . 62.41 109.458 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 73.7 mtm180 -63.2 -34.31 77.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.225 0.536 . . . . 73.51 110.116 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -129.98 89.49 45.5 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 115.917 -0.583 . . . . 74.52 110.47 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.43 72.63 5.9 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.657 2.238 . . . . 53.31 111.167 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -157.36 143.4 17.7 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.964 -0.562 . . . . 60.23 109.941 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.4 p -144.84 172.58 12.82 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.684 0.278 . . . . 72.5 110.551 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -88.68 -5.19 58.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.412 0.625 . . . . 75.0 109.434 177.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.482 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 43.0 mtp180 -98.63 -48.36 5.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.097 -0.956 . . . . 75.24 111.087 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -114.63 146.93 40.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.152 -0.477 . . . . 73.35 110.56 -175.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -83.58 -47.22 11.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 74.55 110.25 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -121.42 116.96 25.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.381 -0.6 . . . . 51.34 109.381 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.6 mm -75.98 94.02 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.176 -0.465 . . . . 72.24 111.442 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 m -87.54 -25.59 23.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.279 0.562 . . . . 73.32 110.096 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.417 ' HA ' ' OE2' ' A' ' 38' ' ' GLU . 9.1 ptt180 -60.43 119.47 8.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.362 -0.836 . . . . 73.33 111.834 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -80.72 -178.14 6.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.878 -0.601 . . . . 73.25 110.644 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.16 -35.19 79.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.466 -0.334 . . . . 75.12 110.504 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -64.01 -43.16 96.47 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.3 -0.409 . . . . 62.31 110.976 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 42.4 mt-10 -62.7 -41.37 99.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 74.22 110.653 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.488 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.11 -40.3 97.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.134 -0.484 . . . . 63.22 110.21 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.67 -42.46 91.3 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.7 -0.682 . . . . 64.03 109.974 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -59.54 -42.08 91.5 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.276 -0.42 . . . . 75.23 110.595 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.8 mt -62.04 -45.85 91.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.973 -0.558 . . . . 75.3 110.419 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 39' ' ' ALA . 42.9 mm -55.99 -53.15 41.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.155 -0.475 . . . . 74.04 110.817 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.45 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 88.5 m-20 -59.49 -43.7 93.26 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.471 -0.332 . . . . 74.45 110.592 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.42 -49.94 71.64 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.963 -0.562 . . . . 65.13 112.096 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.474 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.2 m-85 -61.04 -51.96 66.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.327 0.108 . . . . 75.14 110.784 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 69.7 mt -54.75 -43.29 66.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.829 0.347 . . . . 71.14 111.117 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 14.6 mm100 -63.81 -45.58 88.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.398 -0.365 . . . . 55.14 111.141 178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -69.01 -36.26 77.6 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 111.842 0.312 . . . . 64.23 111.842 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 46' ' ' TYR . 83.9 mt -61.42 -49.74 83.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.291 . . . . 64.2 110.744 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -64.66 -34.94 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.22 111.472 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.8 m -65.51 -31.29 72.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.304 -0.407 . . . . 72.0 111.497 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.91 25.65 6.72 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.562 -0.827 . . . . 63.15 111.826 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -89.24 -75.41 0.44 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.118 0.485 . . . . 40.45 110.207 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 8.7 mm-40 -109.67 146.3 35.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.66 -0.7 . . . . 70.31 109.545 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -88.71 159.53 17.76 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 109.643 -0.503 . . . . 74.35 109.643 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -53.59 -42.01 67.17 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.639 0.257 . . . . 71.51 111.126 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.49 -12.74 61.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.386 -0.37 . . . . 74.51 111.559 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -80.01 -29.75 39.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.056 0.455 . . . . 45.13 110.313 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.2 -45.86 7.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.42 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.99 67.27 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.734 0.642 . . . . 72.43 112.734 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.622 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 15.0 m -88.91 -3.25 58.79 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.312 0.486 . . . . 64.54 112.312 -177.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -133.5 -47.32 0.82 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.341 0.497 . . . . 73.24 112.341 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -99.25 23.79 8.76 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.132 0.419 . . . . 75.14 112.132 -174.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -112.47 127.63 56.1 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.083 0.468 . . . . 74.31 110.375 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.482 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 8.2 m-20 -90.24 65.97 6.48 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.023 -0.535 . . . . 73.13 110.252 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.2 p -155.87 169.17 25.04 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.134 -0.485 . . . . 71.35 110.173 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.8 m -69.71 -23.71 63.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.008 0.433 . . . . 74.12 110.588 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.1 m -67.27 -15.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.901 -0.591 . . . . 71.25 111.73 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.34 -30.13 70.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.193 0.52 . . . . 71.22 110.605 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -84.09 -7.95 59.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.925 -0.579 . . . . 72.44 109.974 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.41 21.72 16.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.583 -0.735 . . . . 65.54 110.841 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.622 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 26.9 mtp180 69.45 12.93 8.36 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.996 -0.547 . . . . 74.03 111.699 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.43 -10.31 73.82 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.211 -0.755 . . . . 71.05 111.211 -177.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -71.58 129.33 38.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.815 0.34 . . . . 54.02 110.745 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.468 HD22 ' O ' ' A' ' 76' ' ' LEU . 4.8 tt -89.07 -35.47 16.31 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.166 -0.679 . . . . 74.44 109.166 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.77 -178.02 33.37 Favored Glycine 0 N--CA 1.432 -1.595 0 N-CA-C 110.449 -1.061 . . . . 61.34 110.449 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 112.97 11.87 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.925 0.362 . . . . 63.23 110.132 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -116.03 151.57 35.23 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.814 0.34 . . . . 71.22 111.301 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -169.53 -169.62 0.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.267 -0.642 . . . . 62.54 109.267 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 63.16 18.77 11.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.215 0.606 . . . . 74.44 112.521 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 66.0 33.75 86.43 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.863 -0.684 . . . . 72.51 112.736 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -83.24 -14.26 53.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.894 0.378 . . . . 71.42 111.027 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.5 tpp -115.64 154.27 29.78 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.991 -0.55 . . . . 73.54 109.586 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -51.45 134.49 28.73 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.466 0.479 . . . . 64.31 111.674 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.7 tptt -56.61 -47.78 98.37 Favored Pre-proline 0 CA--C 1.548 0.88 0 N-CA-C 112.809 0.67 . . . . 60.04 112.809 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.533 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.1 Cg_endo -54.74 -25.18 41.19 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.257 1.972 . . . . 74.43 111.979 177.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CE2' HG12 ' A' ' 113' ' ' ILE . 41.3 t80 -85.84 -43.47 13.26 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.71 -0.677 . . . . 74.31 109.33 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.6 -51.64 68.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.383 -0.826 . . . . 73.45 111.31 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . 0.458 ' OD2' ' HE3' ' A' ' 86' ' ' LYS . 8.8 m-20 -54.5 -46.57 73.49 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.535 -0.302 . . . . 71.4 111.078 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.653 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -64.68 -42.24 95.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.806 -0.634 . . . . 74.35 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -65.68 -45.2 83.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.83 0.348 . . . . 71.34 111.269 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -65.73 -24.83 67.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.158 -0.474 . . . . 73.35 111.314 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.76 -5.38 59.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.283 -0.417 . . . . 41.31 111.574 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 96.6 mt -96.69 143.68 27.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.706 0.289 . . . . 72.44 110.389 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -92.17 -179.73 5.33 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.345 -0.389 . . . . 72.42 110.245 176.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.3 m -64.79 125.12 23.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.944 -0.571 . . . . 75.32 110.324 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.29 21.55 64.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.901 -0.666 . . . . 62.33 111.999 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -111.81 143.91 41.98 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.037 0.446 . . . . 72.11 110.917 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -124.79 134.83 52.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.449 -0.796 . . . . 71.43 109.773 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -80.11 -69.0 0.62 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.009 0.433 . . . . 74.11 111.02 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.41 ' O ' ' HA ' ' A' ' 112' ' ' ILE . . . 139.69 -142.82 13.07 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 111.188 -0.765 . . . . 72.11 111.188 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -76.45 98.37 1.2 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.552 2.168 . . . . 75.24 112.933 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -95.08 110.95 24.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.237 -0.653 . . . . 73.01 109.237 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -82.51 122.94 28.7 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.126 -0.488 . . . . 75.02 111.834 -177.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.0 p -136.74 174.39 10.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.61 -0.723 . . . . 63.12 109.669 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -62.99 -31.2 72.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.932 0.396 . . . . 73.14 110.961 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.4 p -79.76 -5.65 55.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 71.51 111.793 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 123.1 -156.72 17.52 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.687 -0.768 . . . . 63.3 111.886 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 48.4 mt -97.62 126.97 50.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.588 0.233 . . . . 75.23 110.387 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . 0.551 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 93.1 m-70 -114.34 135.44 54.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.517 -0.311 . . . . 75.34 111.204 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 45.3 mt -105.75 125.37 61.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 107.915 -1.143 . . . . 71.5 107.915 173.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ILE . . . . . 0.471 HG12 ' CE2' ' A' ' 88' ' ' PHE . 32.0 mt -107.71 128.96 62.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.791 0.329 . . . . 65.31 111.779 -176.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.5 tp -131.44 108.88 9.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.771 -0.649 . . . . 71.33 109.589 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -81.43 120.84 25.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.74 0.305 . . . . 75.32 110.68 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 p -100.05 -29.21 12.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.335 -0.393 . . . . 64.3 111.278 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.485 -0.769 . . . . 61.32 110.697 179.814 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 121.287 0.565 . . . . 61.33 109.653 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -127.28 117.17 21.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.345 -0.843 . . . . 73.52 109.788 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.52 137.08 57.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-N 116.327 -0.397 . . . . 72.11 110.378 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 36.6 ttt180 -112.31 125.84 54.62 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.464 -0.334 . . . . 75.52 110.183 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -143.23 139.18 30.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.0 0.429 . . . . 51.01 111.204 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 15.4 m -98.29 153.87 18.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.428 -0.953 . . . . 41.51 108.428 176.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 145.83 37.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.406 0.891 . . . . 71.12 113.406 -175.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.432 ' HG ' ' HB2' ' A' ' 65' ' ' SER . 10.4 tt -122.59 141.01 52.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.945 -1.025 . . . . 73.25 108.322 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.59 HD23 ' CD2' ' A' ' 111' ' ' HIS . 2.7 tm? -139.17 131.05 27.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.93 0.395 . . . . 70.42 110.944 -178.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.414 ' N ' HD22 ' A' ' 15' ' ' LEU . 73.4 t -123.63 126.17 72.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.786 -0.82 . . . . 75.2 108.786 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.449 ' HE2' ' HB3' ' A' ' 26' ' ' SER . 60.8 mttm -71.74 171.48 11.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.063 0.459 . . . . 63.34 111.236 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -142.31 168.72 19.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.805 -0.634 . . . . 64.43 110.117 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.6 m -56.59 -34.63 67.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.896 0.702 . . . . 64.25 112.896 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -89.84 12.64 16.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.416 0.524 . . . . 75.52 112.416 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.5 m -74.59 154.17 38.68 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 110.335 -0.246 . . . . 62.32 110.335 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.15 -42.24 99.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.962 0.411 . . . . 61.14 111.111 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -106.41 104.7 51.61 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 109.51 -0.552 . . . . 74.42 109.51 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.484 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 86.6 Cg_endo -82.93 22.39 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.886 2.391 . . . . 73.32 112.36 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 17' ' ' LYS . 25.8 p -144.44 155.72 43.87 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.699 -0.482 . . . . 72.32 109.699 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.449 ' HB3' ' HE2' ' A' ' 17' ' ' LYS . 88.9 p -136.27 -165.94 1.8 Allowed 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.773 0.32 . . . . 65.43 110.276 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -92.66 8.4 39.3 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.343 0.592 . . . . 64.34 109.868 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -134.35 -32.03 1.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.566 -0.743 . . . . 75.4 111.481 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -116.6 148.19 41.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.855 -0.424 . . . . 52.23 109.855 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -85.15 -39.81 17.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 64.31 110.74 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 25.4 pttm -143.77 134.93 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.925 -0.579 . . . . 75.11 110.527 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mm -88.63 94.08 4.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.176 -0.466 . . . . 61.02 110.143 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 m -82.54 -22.72 34.87 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.717 -0.674 . . . . 70.33 110.653 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -73.05 134.77 44.71 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.172 -0.467 . . . . 61.31 111.003 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.9 t -92.5 -171.16 2.69 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.311 -0.404 . . . . 54.21 110.23 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -52.15 -53.87 37.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.164 0.585 . . . . 62.13 111.783 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 13.7 mm-40 -64.39 -39.99 94.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.174 -0.466 . . . . 73.33 112.221 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.82 -37.9 87.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.897 0.379 . . . . 71.55 110.91 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -72.59 -35.79 67.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.107 0.48 . . . . 52.33 109.975 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 40.1 tp -62.55 -37.5 86.38 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.531 -0.759 . . . . 64.41 111.059 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 48.4 mt-10 -60.99 -42.42 98.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.106 178.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.3 -45.71 90.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.029 -0.532 . . . . 74.11 109.984 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.1 mm -54.45 -53.2 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.766 -0.652 . . . . 75.34 110.645 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -62.04 -35.33 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.049 -0.523 . . . . 73.44 110.99 179.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -61.33 -48.98 82.33 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.565 -0.614 . . . . 71.3 111.565 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' CD1' HD12 ' A' ' 60' ' ' LEU . 15.8 m-85 -56.61 -51.42 68.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.869 0.366 . . . . 72.14 110.113 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 78.3 mt -55.89 -48.8 77.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 115.515 -0.766 . . . . 65.31 111.316 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.78 -42.11 92.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.286 -0.416 . . . . 73.42 111.493 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 45.1 mtpt -62.97 -42.26 99.78 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.794 0.33 . . . . 73.44 111.113 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 78.9 mt -64.98 -47.94 86.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.141 -0.481 . . . . 73.02 111.024 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -64.17 -32.93 74.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.722 0.296 . . . . 74.11 111.566 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.8 m -76.23 -28.37 57.15 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.801 0.334 . . . . 74.2 111.312 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.35 13.37 28.71 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.397 -0.906 . . . . 74.32 111.933 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.64 -46.49 63.19 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.531 -0.544 . . . . 64.52 109.531 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 36.7 mt-10 -145.28 177.38 8.85 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.576 -0.738 . . . . 74.51 109.807 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -118.55 157.31 27.57 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.01 -0.737 . . . . 72.33 109.01 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -55.16 -24.74 28.13 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.331 0.493 . . . . 43.42 112.331 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -55.21 -51.0 67.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.922 0.341 . . . . 73.42 111.922 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.0 p -70.51 -39.71 73.93 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 120.906 0.384 . . . . 61.31 110.992 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.447 HD12 ' CD1' ' A' ' 46' ' ' TYR . 3.6 mm? -64.15 -46.94 81.83 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.982 -0.553 . . . . 73.22 111.336 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.504 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -72.95 -10.37 59.73 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.256 0.465 . . . . 74.43 112.256 -178.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.619 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 40.5 m -101.49 -52.25 3.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 64.33 111.793 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -102.62 -2.57 28.12 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.01 0.744 . . . . 70.14 113.01 -174.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -128.69 16.68 6.39 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 120.827 0.346 . . . . 73.41 111.05 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.432 ' HB2' ' HG ' ' A' ' 14' ' ' LEU . 23.3 t -125.27 149.89 47.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 73.4 111.063 -178.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -92.0 -14.96 28.59 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.581 -0.736 . . . . 74.32 110.306 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.1 m -55.3 134.1 49.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.751 -0.659 . . . . 74.42 111.241 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.6 m -60.02 -25.83 65.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 73.11 110.808 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 m -68.64 -6.8 28.0 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.077 -0.511 . . . . 70.23 111.602 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.73 -29.1 58.93 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.669 0.387 . . . . 42.2 111.704 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -71.43 -17.32 62.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.05 0.453 . . . . 74.51 110.898 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 73' ' ' ARG . . . -114.16 30.03 7.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.84 -0.618 . . . . 52.21 109.922 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.619 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 86.8 mtm180 74.37 10.87 4.2 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.549 -0.751 . . . . 75.05 112.406 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.504 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 86.17 2.51 85.68 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.843 -0.694 . . . . 62.45 113.126 177.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.474 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 30.4 t70 -85.23 140.72 30.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.903 0.382 . . . . 74.51 111.247 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.5 mt -94.01 -12.2 29.16 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 71.42 110.645 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 81.09 -166.32 48.22 Favored Glycine 0 N--CA 1.436 -1.351 0 N-CA-C 111.169 -0.773 . . . . 52.31 111.169 -177.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.84 109.11 17.86 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.935 0.398 . . . . 72.13 110.412 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.9 p90 -115.93 176.45 5.08 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 116.211 -0.449 . . . . 74.21 110.21 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.5 t -121.54 -172.13 2.36 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 110.05 -0.352 . . . . 74.54 110.05 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -73.8 149.33 41.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.205 -0.452 . . . . 62.41 110.255 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.96 36.19 57.46 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.792 -0.718 . . . . 23.51 111.745 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -126.8 -22.91 3.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.663 0.268 . . . . 64.12 111.534 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.434 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 46.8 tpp -131.63 164.54 25.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.736 -0.211 . . . . 74.44 110.902 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -52.32 139.63 23.83 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.585 -0.279 . . . . 42.4 110.44 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 55.8 tptt -51.57 -51.45 69.46 Favored Pre-proline 0 CA--C 1.551 1.004 0 N-CA-C 113.408 0.892 . . . . 73.41 113.408 -176.142 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.7 Cg_exo -56.32 -28.62 72.97 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.073 1.848 . . . . 63.12 112.741 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.588 ' CE2' HG12 ' A' ' 113' ' ' ILE . 21.4 t80 -90.25 -52.33 4.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.161 -0.472 . . . . 75.33 110.346 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.27 -49.84 76.02 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.736 -0.665 . . . . 72.52 111.439 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.75 -32.7 74.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 73.31 110.725 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.34 -37.16 71.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.042 -0.526 . . . . 62.21 110.142 178.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.458 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 40.3 m -59.01 -45.19 91.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.276 -0.42 . . . . 73.22 110.595 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -69.82 -28.31 65.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.394 -0.366 . . . . 65.41 111.026 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.81 -30.91 59.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 62.45 111.073 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 89.8 mt -72.2 168.03 19.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.466 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -104.06 173.52 6.27 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.313 -0.403 . . . . 73.32 109.972 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.1 m -69.51 116.21 9.66 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.879 -0.415 . . . . 51.34 109.879 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.51 45.96 5.36 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.888 -0.885 . . . . 51.15 110.888 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.41 130.86 52.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.698 0.285 . . . . 65.25 110.768 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.2 ttp -109.3 108.28 18.81 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.114 -0.494 . . . . 71.34 109.754 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.451 ' HB2' HD11 ' A' ' 95' ' ' LEU . 47.7 t -73.25 155.9 39.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.777 -0.647 . . . . 62.03 110.653 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.42 -154.64 15.03 Favored Glycine 0 N--CA 1.435 -1.41 0 CA-C-N 115.775 -0.648 . . . . 53.24 112.231 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.79 104.57 0.69 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.054 2.503 . . . . 71.44 113.053 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.9 t -101.78 117.65 47.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 51.2 109.688 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.13 124.14 28.99 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.902 0.382 . . . . 72.23 110.996 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -135.0 -173.72 3.39 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 116.193 -0.458 . . . . 72.14 109.927 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 106' ' ' THR . 4.6 m-20 -49.61 -61.9 1.85 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.713 0.805 . . . . 72.45 112.699 -177.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.5 p -64.8 -37.23 86.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.459 0.54 . . . . 74.5 112.459 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 163.06 -139.19 5.75 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.635 -0.793 . . . . 72.3 112.009 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.5 mt -91.21 129.18 42.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 120.776 0.322 . . . . 71.04 110.145 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.59 ' CD2' HD23 ' A' ' 15' ' ' LEU . 10.7 m170 -116.69 143.81 45.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.106 -0.497 . . . . 72.35 110.996 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 52.2 mt -110.73 126.16 68.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 108.138 -1.06 . . . . 75.21 108.138 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.588 HG12 ' CE2' ' A' ' 88' ' ' PHE . 20.2 mt -108.18 116.44 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.65 0.262 . . . . 71.44 111.295 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.7 tp -113.5 101.65 9.55 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 110.018 -0.364 . . . . 74.32 110.018 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 92' ' ' SER . 75.0 ttt180 -84.7 106.78 16.51 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.669 -0.412 . . . . 75.23 109.976 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.1 p -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.065 -0.516 . . . . 74.34 110.719 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.359 -0.829 . . . . 64.23 110.322 179.851 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.393 0 CA-C-O 121.053 0.454 . . . . 72.13 110.295 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HG2' ' HB1' ' A' ' 78' ' ' ALA . 74.9 ttt180 -111.75 111.32 22.21 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.562 -0.903 . . . . 74.44 108.562 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.93 160.74 8.77 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-O 121.133 0.492 . . . . 62.2 111.796 -174.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.556 ' HB3' ' CG ' ' A' ' 117' ' ' GLU . 67.0 ttt180 -133.27 122.57 24.1 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 109.236 -0.653 . . . . 74.52 109.236 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -134.78 145.41 48.37 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.074 0.464 . . . . 72.34 111.336 -177.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -99.89 140.95 33.36 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.231 -1.026 . . . . 73.51 108.231 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.526 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 9.4 p80 -125.4 133.33 52.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.935 0.717 . . . . 74.41 112.935 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.477 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 6.5 tt -112.84 124.04 51.68 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.349 -1.352 . . . . 54.43 107.349 174.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HB3' ' HB2' ' A' ' 67' ' ' SER . 39.9 tp -108.89 127.77 54.33 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 112.23 0.455 . . . . 51.43 112.23 -177.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.3 p -118.03 114.0 43.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.354 -0.839 . . . . 52.35 108.943 174.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -85.16 175.62 8.86 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.031 -0.531 . . . . 63.4 111.166 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -145.15 165.59 27.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.108 -0.496 . . . . 73.13 110.701 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 32' ' ' ILE . 33.3 t -54.93 -52.21 63.68 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.682 0.614 . . . . 71.32 112.281 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -84.03 38.22 0.64 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.211 0.449 . . . . 52.41 112.211 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.4 t -91.54 162.63 14.45 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.973 -0.38 . . . . 73.41 109.973 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -12.52 60.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.228 0.537 . . . . 74.42 110.446 177.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -149.69 83.1 6.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.499 -0.773 . . . . 72.44 109.056 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -81.46 25.57 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.389 2.726 . . . . 53.14 112.576 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.0 p -122.9 138.9 54.53 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.522 -0.308 . . . . 65.02 110.67 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -136.11 -167.08 1.98 Allowed 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.421 -0.354 . . . . 75.32 110.285 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 68.6 p-90 -83.75 -19.51 35.01 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.257 -0.428 . . . . 74.23 110.429 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -102.73 -43.55 5.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.984 -0.553 . . . . 50.41 110.97 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -124.07 115.52 21.3 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.3 -0.63 . . . . 72.21 109.3 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -67.93 -31.2 70.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.393 -0.367 . . . . 74.04 110.605 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 20.6 ptmt -134.86 105.99 6.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.268 0.556 . . . . 75.21 111.02 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 19' ' ' SER . 28.4 mm -71.73 122.32 23.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.662 -0.699 . . . . 72.1 109.281 177.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.6 p -104.75 -17.85 14.47 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.653 0.263 . . . . 73.31 111.426 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -65.36 141.8 58.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.845 0.355 . . . . 73.21 110.327 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.9 t -97.59 -179.15 4.37 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.448 -0.342 . . . . 64.11 110.995 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -56.65 -47.64 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.911 -0.586 . . . . 62.32 111.464 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 10.8 mm-40 -59.18 -45.47 90.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.029 -0.532 . . . . 64.43 111.097 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.65 -38.84 92.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 54.21 110.505 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.12 -40.8 90.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 71.54 110.722 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.39 -38.98 89.01 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.244 -0.435 . . . . 71.33 110.433 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 49.2 mt-10 -63.54 -35.47 80.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 74.43 110.252 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.8 mt -70.02 -41.36 74.41 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.752 -0.658 . . . . 74.42 109.946 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.5 mm -53.51 -55.79 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.963 -0.562 . . . . 54.23 110.15 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.592 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.6 m-20 -57.26 -40.06 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.623 -0.717 . . . . 73.21 110.716 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.46 -46.83 93.28 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.98 -0.555 . . . . 71.11 112.181 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -60.62 -44.73 96.0 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.062 0.458 . . . . 74.14 109.909 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 43' ' ' ILE . 70.1 mt -56.88 -45.94 83.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-N 115.529 -0.76 . . . . 71.34 111.075 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 66.1 mm-40 -60.6 -44.76 95.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 72.31 110.979 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.471 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 66.4 mttm -62.18 -40.96 97.79 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.066 -0.516 . . . . 54.23 111.63 -177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.5 mt -72.27 -47.82 51.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.184 -0.462 . . . . 63.04 111.475 -178.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.49 -26.6 65.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.526 0.565 . . . . 73.25 112.526 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -85.07 -1.19 56.56 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.879 0.371 . . . . 72.12 111.274 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.44 75.43 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.788 -0.72 . . . . 31.15 112.417 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -84.54 -54.98 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.449 -0.575 . . . . 73.33 109.449 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.471 ' OE2' ' HD3' ' A' ' 49' ' ' LYS . 43.3 mt-10 -133.37 176.48 8.49 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.23 -0.895 . . . . 74.24 109.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.494 ' O ' HD13 ' A' ' 60' ' ' LEU . 3.1 p30 -122.77 165.26 16.87 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.244 0.545 . . . . 75.11 111.683 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.5 t80 -61.84 -43.72 98.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.176 -0.92 . . . . 75.52 111.82 -176.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 73' ' ' ARG . 45.6 mt-10 -64.29 -42.83 96.22 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.282 0.475 . . . . 72.21 112.282 -176.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.9 t -66.58 -34.93 79.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.136 0.494 . . . . 72.14 110.191 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' ASP . 10.5 mp -77.84 -29.69 50.63 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.894 -0.594 . . . . 73.32 111.11 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.96 -49.2 77.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.774 0.321 . . . . 74.45 111.281 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.545 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 26.4 m -75.13 12.04 1.0 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.431 0.53 . . . . 45.51 112.431 -178.14 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -133.77 -57.51 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.398 . . . . 74.32 111.731 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -93.61 21.27 6.49 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.925 -0.579 . . . . 73.03 112.439 -174.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.3 t -118.09 142.43 47.42 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.347 -0.541 . . . . 54.41 110.468 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -97.54 12.57 32.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.891 -0.595 . . . . 74.03 110.473 -178.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 36.1 t -98.38 144.4 27.8 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.211 -0.449 . . . . 51.41 110.807 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.1 m -71.14 -16.25 62.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 74.25 110.177 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -73.33 -6.78 48.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.019 -0.537 . . . . 70.45 110.693 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.545 ' HB1' ' HA ' ' A' ' 62' ' ' SER . . . -67.09 -25.17 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.961 -0.563 . . . . 60.32 109.897 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -64.57 -35.04 79.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.343 -0.844 . . . . 75.22 109.488 177.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.0 19.08 3.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.538 -0.756 . . . . 70.23 110.894 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 58' ' ' GLU . 18.9 mtp180 69.61 8.07 6.55 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.273 0.629 . . . . 72.35 111.785 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.19 -9.75 68.72 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.929 -0.653 . . . . 61.34 113.085 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.1 123.93 30.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.017 0.436 . . . . 62.14 111.535 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.3 mt -90.54 -25.38 20.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.677 -0.692 . . . . 73.23 111.028 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.52 -169.54 16.34 Favored Glycine 0 N--CA 1.434 -1.463 0 N-CA-C 111.072 -0.811 . . . . 45.14 111.072 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 8' ' ' ARG . . . -86.57 109.91 19.45 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.077 0.465 . . . . 74.43 111.197 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -118.25 177.13 4.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.922 -0.581 . . . . 72.32 110.118 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.4 t -141.41 176.49 8.82 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.864 -0.421 . . . . 64.45 109.864 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.618 ' O ' ' HD2' ' A' ' 81' ' ' ARG . 6.9 ppt_? -60.42 128.79 38.42 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.37 0.605 . . . . 72.31 111.733 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 111.82 12.0 15.43 Favored Glycine 0 N--CA 1.437 -1.278 0 CA-C-N 115.317 -0.856 . . . . 72.15 111.354 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.97 -33.33 3.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.885 0.374 . . . . 74.43 110.907 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.464 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 44.1 tpp -112.62 165.31 12.38 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.827 0.346 . . . . 61.02 111.447 -176.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -74.57 148.49 40.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 61.23 110.052 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.2 tptt -40.69 -55.45 4.49 Favored Pre-proline 0 N--CA 1.484 1.248 0 N-CA-C 114.559 1.318 . . . . 74.35 114.559 -175.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 14.8 Cg_endo -55.77 -29.02 69.86 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.731 2.287 . . . . 50.44 113.787 -176.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.503 ' CE2' HG12 ' A' ' 113' ' ' ILE . 10.3 t80 -100.53 -39.76 7.76 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.062 0.458 . . . . 62.4 110.092 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.86 -64.28 0.96 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 75.32 111.414 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.35 -35.41 77.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.847 -0.615 . . . . 73.23 111.391 -176.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -65.41 -33.34 75.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 73.45 111.237 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 71.9 m -64.4 -28.48 69.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.012 0.434 . . . . 74.1 111.536 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.86 -7.27 57.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 75.14 110.569 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.72 -3.59 23.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.979 -0.555 . . . . 74.51 111.466 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.5 mt -99.96 135.97 40.58 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 74.32 111.137 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -98.15 166.53 11.37 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.787 -0.642 . . . . 74.41 110.382 178.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -57.28 123.25 14.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.878 0.371 . . . . 72.21 111.487 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.5 -6.99 77.96 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.76 -0.733 . . . . 72.11 112.28 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -93.24 143.92 25.8 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.989 -0.374 . . . . 73.1 109.989 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.7 ttp -135.08 136.16 41.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.202 -0.454 . . . . 73.25 110.935 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -99.6 123.0 43.45 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.962 -0.755 . . . . 71.42 108.962 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.35 -76.31 1.31 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.698 -0.763 . . . . 60.31 113.937 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.68 83.9 1.29 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.716 2.277 . . . . 74.24 113.862 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 111' ' ' HIS . 90.1 t -116.6 102.85 14.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.155 -0.683 . . . . 53.44 109.155 175.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -83.59 122.69 28.92 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.131 0.491 . . . . 72.55 111.667 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.542 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -131.61 -168.49 2.03 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.857 -0.794 . . . . 73.43 108.857 178.338 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.542 ' H ' HG22 ' A' ' 106' ' ' THR . 5.5 m-20 -55.0 -56.08 23.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.449 0.537 . . . . 62.23 112.449 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.3 p -71.44 -30.63 66.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.775 0.657 . . . . 71.45 112.775 -177.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -138.33 6.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.311 -0.947 . . . . 62.43 111.892 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 49.3 mt -91.7 127.67 43.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 120.929 0.395 . . . . 71.21 110.528 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.518 ' O ' ' HB ' ' A' ' 104' ' ' VAL . 13.5 m-70 -110.56 128.96 55.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.894 -0.593 . . . . 73.41 109.886 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.6 mt -99.38 123.51 52.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.895 -0.779 . . . . 72.43 108.895 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.503 HG12 ' CE2' ' A' ' 88' ' ' PHE . 14.8 mt -107.37 113.9 44.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.138 -0.483 . . . . 73.25 110.982 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 54.0 tp -104.55 123.81 48.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.554 -0.294 . . . . 74.44 110.54 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -87.58 99.16 11.84 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.833 -0.432 . . . . 70.21 109.833 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.5 p -80.87 -46.09 15.81 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.968 -0.56 . . . . 51.53 111.699 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.556 ' CG ' ' HB3' ' A' ' 10' ' ' ARG . 70.8 mm-40 . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.695 -0.669 . . . . 75.44 111.045 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.747 0.308 . . . . 71.55 110.479 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -106.98 142.14 37.07 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.657 -0.497 . . . . 73.11 109.657 177.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.552 HG12 ' NH1' ' A' ' 115' ' ' ARG . 25.9 m -139.38 129.46 31.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 120.878 0.37 . . . . 71.44 111.384 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 0.7 OUTLIER -100.24 107.38 19.2 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 107.806 -1.183 . . . . 75.04 107.806 171.971 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.3 m -133.32 144.7 49.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.806 -0.634 . . . . 74.51 111.367 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -103.52 155.8 18.25 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.536 -0.913 . . . . 73.15 108.536 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.507 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.2 p80 -137.68 141.57 41.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.861 0.689 . . . . 74.21 112.861 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 15' ' ' LEU . 7.4 tt -115.44 143.23 45.6 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.796 -1.187 . . . . 74.24 107.796 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.531 HD13 ' CE1' ' A' ' 111' ' ' HIS . 40.7 tp -126.8 124.65 40.16 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.998 0.427 . . . . 74.25 111.9 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.1 t -112.81 118.39 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 115.445 -0.798 . . . . 74.34 109.056 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -86.5 -173.99 4.79 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.5 0.667 . . . . 74.42 111.284 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -160.65 172.96 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.062 -0.972 . . . . 72.33 108.498 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.7 m -54.05 -42.52 69.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.922 0.342 . . . . 64.2 111.922 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -88.43 54.95 3.22 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 75.21 111.597 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 t -108.03 170.07 8.23 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.827 -0.434 . . . . 73.31 109.827 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.517 ' NE ' ' HA ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -73.28 -30.3 63.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.358 0.599 . . . . 71.11 109.923 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -134.81 94.81 16.17 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.555 -0.748 . . . . 75.11 109.45 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 85.6 Cg_endo -80.01 33.69 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 74.43 112.263 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -143.66 126.57 16.27 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.937 -0.574 . . . . 52.21 109.741 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.3 m -135.6 175.64 9.41 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.398 -0.364 . . . . 72.02 110.627 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -73.28 -14.0 61.23 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.191 -0.459 . . . . 75.32 111.203 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -91.15 -44.24 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 71.02 110.548 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -136.31 134.45 37.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.928 -0.578 . . . . 65.21 110.192 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.43 -47.84 83.94 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.069 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 60.7 pttt -126.66 113.43 16.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.051 0.453 . . . . 70.4 110.485 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.45 104.14 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.703 -0.681 . . . . 74.21 110.199 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.5 m -114.63 96.44 5.75 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 116.017 -0.538 . . . . 73.21 110.221 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -167.47 134.35 2.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.822 -0.626 . . . . 65.4 110.09 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 t -74.99 174.74 8.9 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.735 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -58.05 -38.18 75.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.824 0.345 . . . . 74.54 110.577 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.7 mt-10 -58.02 -46.39 85.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.784 -0.644 . . . . 74.11 110.772 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 74.5 mm-40 -59.96 -43.46 95.04 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.14 111.104 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -64.25 -42.12 96.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.02 -0.536 . . . . 74.32 110.254 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.7 tp -63.73 -43.76 95.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.671 -0.695 . . . . 63.14 110.667 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 64.6 mm-40 -59.95 -43.03 95.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.08 -0.509 . . . . 73.52 110.754 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 83.9 mt -63.89 -48.71 75.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.331 -0.395 . . . . 75.04 110.664 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 39' ' ' ALA . 30.6 mm -55.49 -56.98 9.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.076 -0.511 . . . . 63.03 111.053 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 39.7 m-80 -60.07 -35.95 76.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.266 -0.425 . . . . 71.24 110.892 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.31 -49.48 75.73 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.768 -0.651 . . . . 24.42 111.979 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.423 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 26.6 m-85 -61.24 -47.1 87.62 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.978 -0.378 . . . . 74.32 109.978 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.7 mt -51.12 -51.48 21.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.73 -0.668 . . . . 63.32 111.21 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 68.4 mm-40 -63.18 -40.11 96.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.485 -0.325 . . . . 73.33 111.149 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -62.39 -47.14 85.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.945 0.402 . . . . 63.43 110.957 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.77 -46.02 83.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.914 -0.584 . . . . 75.12 111.369 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -64.45 -38.55 91.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.431 -0.349 . . . . 51.21 111.527 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.1 t -70.62 -20.86 62.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.9 0.381 . . . . 64.31 110.836 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 94.3 18.4 36.41 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.68 -0.771 . . . . 63.32 112.452 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.2 -66.46 0.54 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.184 0.516 . . . . 71.13 111.053 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -137.38 161.88 35.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.518 -0.765 . . . . 73.44 110.692 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -78.7 144.87 34.9 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.048 -0.524 . . . . 71.45 112.089 -177.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.04 -41.73 94.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.662 -0.699 . . . . 74.52 110.055 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -59.83 -33.26 71.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.813 -0.631 . . . . 75.42 110.755 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.9 t -77.89 -34.52 51.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.985 -0.552 . . . . 72.21 110.619 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 99.1 mt -76.71 -40.85 47.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.475 -0.33 . . . . 75.44 111.157 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.58 -16.44 63.86 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.252 0.464 . . . . 75.34 112.252 -177.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.5 p -95.08 -4.65 45.95 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.739 0.304 . . . . 65.13 111.447 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -126.01 -58.68 1.37 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 120.872 0.368 . . . . 70.34 111.909 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.423 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 88.5 m-85 -93.94 38.4 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.257 -0.429 . . . . 71.31 112.058 -174.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -121.63 128.62 52.11 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.198 -0.668 . . . . 65.34 109.198 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -69.37 -28.72 66.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.089 0.471 . . . . 74.25 110.755 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 p -61.83 143.98 55.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 51.13 111.295 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.2 m -74.56 -8.55 56.7 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.195 0.522 . . . . 73.42 110.742 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.7 m -70.46 -4.47 22.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 54.32 111.058 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.53 -32.57 51.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.018 -0.537 . . . . 72.41 111.889 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -66.24 -33.28 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 72.53 110.74 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.62 7.48 36.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.64 -0.504 . . . . 61.43 109.64 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? 64.92 18.37 11.46 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.342 -0.844 . . . . 74.4 110.87 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 67.76 19.88 71.75 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.719 -0.673 . . . . 50.32 112.577 -179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.74 139.05 31.06 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.872 0.336 . . . . 63.22 111.14 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.0 mt -115.21 2.38 14.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.171 -0.468 . . . . 73.24 110.766 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.573 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 71.63 -154.94 51.84 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.36 -0.924 . . . . 72.33 111.062 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -91.87 108.39 19.89 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.859 0.362 . . . . 70.23 110.299 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.42 171.93 7.53 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.156 -0.474 . . . . 63.23 110.675 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.2 t -160.7 171.66 18.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.826 0.346 . . . . 71.45 111.43 -177.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 64.48 -82.38 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.31 1.044 . . . . 73.34 112.91 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -174.43 86.68 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.581 -0.819 . . . . 21.35 112.134 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -102.07 -24.07 14.0 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.483 -0.562 . . . . 54.4 109.483 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' MET . . . . . 0.424 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 35.8 tpp -113.86 172.12 7.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.54 -0.754 . . . . 71.25 109.517 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.96 141.56 33.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.45 0.167 . . . . 72.25 111.221 178.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.447 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.5 tptm -50.32 -50.5 70.46 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 113.645 0.98 . . . . 64.53 113.645 -176.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.447 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 77.0 Cg_exo -52.52 -35.32 66.18 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 121.993 1.796 . . . . 71.32 112.262 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 38.1 t80 -82.11 -50.14 9.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.746 -0.661 . . . . 73.01 110.308 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.493 ' HG2' ' HA2' ' A' ' 82' ' ' GLY . 2.5 tp10 -61.25 -30.04 70.21 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.857 -0.61 . . . . 71.1 111.036 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.6 -29.68 70.2 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.756 -0.657 . . . . 75.15 110.376 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.57 -24.48 21.71 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.771 -0.65 . . . . 61.34 110.922 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 m -58.82 -41.18 86.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.987 0.422 . . . . 64.44 111.077 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -91.24 12.84 18.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 65.02 111.179 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.47 -26.56 26.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.726 0.298 . . . . 72.23 111.26 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.428 ' H ' HD22 ' A' ' 95' ' ' LEU . 1.4 mm? -79.35 127.77 32.5 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.255 -0.429 . . . . 75.15 110.497 -178.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -86.01 -67.21 0.83 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.267 -0.424 . . . . 75.44 111.145 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 65.3 m -138.67 108.06 6.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.61 -0.268 . . . . 73.12 111.34 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.562 ' HA2' ' O ' ' A' ' 115' ' ' ARG . . . 51.56 44.5 53.87 Favored Glycine 0 C--N 1.332 0.337 0 CA-C-N 115.926 -0.579 . . . . 72.55 113.163 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -106.77 161.48 14.63 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 122.692 -0.299 . . . . 70.11 110.745 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.4 ttp -124.7 135.6 53.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.201 -0.454 . . . . 54.5 110.239 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.8 t -89.79 151.39 21.82 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.613 -0.514 . . . . 74.33 109.613 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.54 -144.92 4.59 Favored Glycine 0 N--CA 1.44 -1.04 0 C-N-CA 121.011 -0.614 . . . . 34.43 112.756 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.87 103.36 1.0 Allowed 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.67 2.247 . . . . 73.3 113.184 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -92.89 109.58 21.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.054 -0.521 . . . . 71.45 109.669 177.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -82.28 127.89 33.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.283 -0.417 . . . . 75.23 111.457 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 38.8 p -138.08 -166.16 1.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.806 -0.634 . . . . 61.54 110.165 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -70.43 -47.3 61.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.791 0.329 . . . . 72.1 111.33 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -69.45 -37.77 77.5 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.227 -0.442 . . . . 31.33 111.377 -177.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.93 -138.95 5.68 Favored Glycine 0 N--CA 1.441 -0.993 0 C-N-CA 120.766 -0.73 . . . . 70.04 111.696 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.5 mt -108.4 135.9 45.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 110.107 -0.331 . . . . 71.34 110.107 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.531 ' CE1' HD13 ' A' ' 15' ' ' LEU . 39.7 m-70 -120.4 152.59 37.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.717 0.294 . . . . 74.23 110.784 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 62.9 mt -115.46 128.3 72.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.004 -1.11 . . . . 72.01 108.004 173.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.8 mt -116.24 123.08 71.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.542 0.21 . . . . 72.01 111.112 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.0 tp -120.45 120.96 37.43 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.619 -0.264 . . . . 61.41 111.07 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.562 ' O ' ' HA2' ' A' ' 98' ' ' GLY . 18.8 ttt180 -89.08 119.36 29.52 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.576 -0.898 . . . . 71.53 108.576 175.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 m -85.82 -12.9 49.67 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 120.852 0.358 . . . . 75.31 111.344 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 39.2 mt-10 . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.58 -0.724 . . . . 74.24 110.858 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.811 0.339 . . . . 72.22 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -117.59 121.95 42.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.302 -0.408 . . . . 65.5 110.559 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.5 m -136.23 150.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 116.247 -0.433 . . . . 64.04 110.714 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 74.3 ttt180 -110.44 114.71 28.35 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.914 -0.773 . . . . 62.54 108.914 176.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m -129.01 152.55 48.5 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.25 0.548 . . . . 72.3 111.677 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -104.71 149.93 25.17 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.245 -1.02 . . . . 75.33 108.245 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -139.81 149.29 43.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.706 0.632 . . . . 71.13 112.706 -176.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HA ' ' OG ' ' A' ' 65' ' ' SER . 8.8 tt -118.49 131.43 56.25 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.361 -0.977 . . . . 73.15 108.361 175.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.627 ' O ' ' HA ' ' A' ' 65' ' ' SER . 2.6 tm? -123.69 112.12 17.0 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.847 0.356 . . . . 71.22 110.535 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.409 HG11 HD11 ' A' ' 43' ' ' ILE . 9.3 p -109.99 122.23 64.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.429 0.633 . . . . 70.55 110.605 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -85.03 177.46 7.92 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.597 -0.729 . . . . 75.23 110.922 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.32 173.85 15.07 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.015 -0.539 . . . . 71.45 110.371 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.1 p -56.64 -53.59 55.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.258 0.466 . . . . 74.5 112.258 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -89.83 47.16 1.43 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.12 0.486 . . . . 73.5 110.696 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.2 t -92.3 173.91 7.57 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.977 -0.556 . . . . 42.53 110.419 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.46 ' HD2' ' OD1' ' A' ' 107' ' ' ASP . 46.6 ttt180 -68.89 -22.38 64.19 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.494 -0.928 . . . . 70.33 108.494 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.2 tpp180 -150.46 98.61 3.24 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 114.562 -1.199 . . . . 71.42 108.746 176.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.412 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 71.8 Cg_endo -76.14 26.07 0.42 Allowed 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.214 2.609 . . . . 73.11 112.971 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.9 m -130.92 147.39 52.56 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.986 -0.552 . . . . 72.31 109.565 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.4 p -134.31 -178.42 5.04 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.88 0.371 . . . . 72.41 110.337 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 66' ' ' ASP . 44.4 p-90 -81.53 -0.78 43.57 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.587 -0.523 . . . . 75.32 109.587 175.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -102.36 -52.55 3.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.565 -0.743 . . . . 73.25 110.261 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -132.65 165.23 24.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.34 111.462 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.69 -38.91 28.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.034 -0.53 . . . . 53.12 111.184 -177.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 17.9 ptmt -135.67 125.58 25.79 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 120.936 0.398 . . . . 54.31 111.172 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.15 122.07 34.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.992 -0.549 . . . . 75.14 109.811 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.0 m -86.84 -40.44 14.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.579 0.228 . . . . 74.54 111.104 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -63.33 125.87 25.57 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.364 0.602 . . . . 75.33 111.804 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.421 HG22 ' HG2' ' A' ' 38' ' ' GLU . 9.6 t -81.85 171.25 14.71 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.737 -0.665 . . . . 73.52 109.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -58.82 -33.48 70.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.887 0.375 . . . . 74.33 110.575 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.43 -41.97 98.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.91 -0.586 . . . . 75.45 110.807 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.421 ' HG2' HG22 ' A' ' 35' ' ' THR . 43.8 mm-40 -71.25 -39.74 71.45 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.966 -0.561 . . . . 71.32 110.466 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.492 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.39 -40.22 96.63 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.669 -0.696 . . . . 71.43 110.823 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.87 -43.76 77.44 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.144 -0.48 . . . . 73.25 111.603 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -58.45 -45.96 87.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.166 0.507 . . . . 62.3 110.287 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.77 -46.56 74.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.5 -0.773 . . . . 64.3 110.563 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.2 mm -56.55 -53.67 38.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.896 -0.593 . . . . 70.03 111.283 -179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.41 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 86.8 m-20 -54.72 -45.27 74.03 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 120.976 0.417 . . . . 75.14 110.664 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.73 -54.14 40.1 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.461 -0.791 . . . . 73.22 112.52 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 50' ' ' ILE . 28.5 m-85 -57.36 -46.1 83.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 111.71 0.263 . . . . 62.54 111.71 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.4 mt -55.17 -42.13 63.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 121.053 0.454 . . . . 75.21 110.871 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.3 mm-40 -74.34 -37.76 63.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.18 -0.464 . . . . 71.3 111.194 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 93.5 mttt -66.84 -33.78 76.37 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.472 -0.331 . . . . 73.23 111.131 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.602 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 89.5 mt -63.55 -43.07 98.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.966 0.412 . . . . 73.01 110.135 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -76.07 -1.67 27.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.068 -0.515 . . . . 75.11 111.139 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.4 t -103.24 -1.96 28.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.101 -0.5 . . . . 74.31 110.118 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.48 2.38 90.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.996 -0.621 . . . . 74.14 113.06 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -68.56 -65.49 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.993 0.425 . . . . 52.34 110.554 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.602 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 61.3 mm-40 -119.64 151.53 38.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.887 -0.597 . . . . 74.35 110.139 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -97.6 152.87 18.61 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.355 -0.609 . . . . 54.54 109.355 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -53.8 -40.09 66.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.527 -0.306 . . . . 75.43 111.711 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -65.85 -19.34 65.84 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 73.03 111.621 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 t -75.44 -38.0 59.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.108 0.48 . . . . 54.54 110.444 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.15 -40.64 13.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.122 -0.49 . . . . 63.45 111.112 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.67 -32.12 68.82 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.131 0.419 . . . . 62.21 112.131 -177.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 28.6 p -82.66 -14.39 54.76 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.248 0.462 . . . . 54.34 112.248 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -124.12 18.23 9.18 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.324 0.49 . . . . 74.53 112.324 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -139.31 -42.06 0.46 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 111.801 0.297 . . . . 64.51 111.801 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.6 m -64.57 132.09 48.86 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.176 0.512 . . . . 74.34 112.365 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.499 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . 20.8 t70 -84.6 -22.46 29.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.791 -0.641 . . . . 74.43 109.444 174.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -59.34 151.44 23.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.218 -0.901 . . . . 73.34 110.984 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.2 m -61.25 -13.12 16.29 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.278 0.473 . . . . 51.41 112.278 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 m -76.87 -6.19 51.41 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.592 -0.276 . . . . 70.35 111.186 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.412 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -55.93 -54.78 40.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.912 0.387 . . . . 72.01 111.337 -178.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -71.69 -8.41 53.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.941 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.78 13.75 32.63 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.913 -0.585 . . . . 42.04 110.174 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 69.91 15.71 7.8 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.267 -0.879 . . . . 71.12 112.57 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.77 -22.17 41.64 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.124 -0.56 . . . . 72.41 113.031 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.24 131.38 49.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.718 0.636 . . . . 74.53 112.718 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.41 -18.39 16.75 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 72.42 111.04 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.61 -175.43 40.56 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 110.898 -0.881 . . . . 51.54 110.898 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.79 122.53 24.2 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.904 0.352 . . . . 63.33 110.732 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -133.91 179.2 6.39 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.341 -0.39 . . . . 64.42 110.399 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -133.21 175.82 9.05 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 120.749 0.309 . . . . 61.04 110.317 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -78.78 156.38 28.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 74.14 111.391 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.402 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 86.01 28.38 28.67 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 116.051 -0.522 . . . . 74.54 111.961 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -127.91 -51.8 1.33 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.748 0.277 . . . . 75.11 111.748 -178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -91.91 175.61 6.82 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.749 0.309 . . . . 45.32 110.793 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -65.28 139.33 58.6 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.762 -0.459 . . . . 73.31 109.762 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.0 tptm -51.37 -52.06 63.07 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 113.456 0.91 . . . . 62.34 113.456 -175.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.6 Cg_endo -53.57 -27.33 40.73 Favored 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.419 2.079 . . . . 64.21 112.906 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -93.28 -50.86 5.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.089 0.471 . . . . 71.41 110.56 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.402 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 35.2 tt0 -61.94 -46.24 90.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.64 -0.709 . . . . 64.52 111.324 -177.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.29 -40.14 89.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.081 -0.509 . . . . 73.45 110.608 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -68.29 -31.97 71.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.874 -0.603 . . . . 74.12 110.804 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 m -68.65 -46.09 70.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.12 -0.491 . . . . 72.54 110.853 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -77.18 -10.23 59.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 74.25 111.619 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.23 8.51 32.74 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.116 0.484 . . . . 63.33 110.496 178.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 79.3 mt -101.57 131.75 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.857 -0.61 . . . . 64.34 110.581 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.5 mtm180 -76.87 172.75 12.63 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.269 -0.423 . . . . 71.44 110.106 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.0 m -55.42 111.88 0.98 Allowed 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.033 0.444 . . . . 74.32 111.868 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.32 49.77 11.42 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.801 -0.636 . . . . 61.35 112.765 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -129.19 156.26 44.22 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.878 0.371 . . . . 62.13 110.995 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.1 ttp -118.3 136.12 53.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.887 -0.597 . . . . 70.5 110.759 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.3 t -83.67 159.54 21.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.017 -0.538 . . . . 65.44 110.902 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.0 -171.09 44.28 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 111.33 -0.708 . . . . 32.25 111.33 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -65.44 107.01 0.93 Allowed 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.872 2.381 . . . . 72.22 112.774 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 91.1 t -89.68 120.56 38.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.63 -0.507 . . . . 55.24 109.63 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -95.85 133.37 40.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.057 0.456 . . . . 71.01 111.226 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 33.9 p -142.88 -173.71 3.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.882 -0.599 . . . . 74.45 110.189 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.46 ' OD1' ' HD2' ' A' ' 22' ' ' ARG . 2.1 p30 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 72.15 111.078 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.9 p -84.43 -41.83 16.24 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.442 . . . . 72.41 110.82 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.89 -149.84 18.67 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 120.696 -0.764 . . . . 60.41 111.945 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.4 mt -98.44 133.01 42.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.72 -0.474 . . . . 70.34 109.72 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -117.03 129.13 55.81 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.276 -0.42 . . . . 62.43 110.698 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.433 HD11 HG23 ' A' ' 43' ' ' ILE . 32.0 mt -107.49 137.5 38.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.784 -1.191 . . . . 60.24 107.784 173.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 24.4 mt -124.88 129.83 73.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.786 -0.366 . . . . 73.35 111.172 -176.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.3 tp -122.71 116.23 23.41 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.257 -0.645 . . . . 74.43 109.257 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -78.35 120.08 22.6 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.366 -0.533 . . . . 75.41 110.87 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 16.7 m -85.63 -60.73 1.94 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.581 -0.736 . . . . 63.12 109.898 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 41.2 mm-40 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.31 -0.852 . . . . 62.45 110.199 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.518 0 CA-C-O 120.898 0.38 . . . . 65.13 110.843 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HA ' ' OG ' ' A' ' 80' ' ' SER . 35.6 mtm180 -99.34 106.76 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.273 -0.421 . . . . 73.42 110.275 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.7 m -134.81 154.18 36.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-O 121.077 0.465 . . . . 75.35 111.665 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 10' ' ' ARG . 22.9 ttt180 -117.7 137.9 52.37 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.842 -0.799 . . . . 74.55 108.842 174.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.2 m -146.74 148.53 32.05 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.959 0.409 . . . . 75.32 110.933 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.5 m -102.06 148.52 25.28 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.202 -1.036 . . . . 65.31 108.202 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.48 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.8 p80 -136.75 132.21 34.47 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.833 0.679 . . . . 71.24 112.833 -176.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.21 124.8 50.83 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.985 -1.117 . . . . 72.53 107.985 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.478 HD13 ' CD2' ' A' ' 111' ' ' HIS . 28.8 tp -120.8 124.24 44.59 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.02 0.438 . . . . 75.42 111.777 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.85 115.66 50.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.414 -0.812 . . . . 40.55 108.969 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -83.31 175.09 10.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.091 0.472 . . . . 74.3 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -152.12 162.3 41.31 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.832 -0.622 . . . . 74.31 110.048 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -56.28 -49.71 73.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.245 0.545 . . . . 74.01 111.13 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -80.01 40.28 0.47 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.677 -0.692 . . . . 74.01 111.638 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.7 t -105.98 -173.35 2.28 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.285 -0.635 . . . . 72.0 109.285 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 22' ' ' ARG . 36.2 mtp85 -72.44 -23.92 61.14 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.294 0.568 . . . . 75.41 109.722 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' ' H ' ' A' ' 25' ' ' SER . 19.4 ttm180 -146.59 114.13 4.39 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 65.24 110.055 177.284 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -87.18 21.89 1.0 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.921 2.414 . . . . 62.35 111.631 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.51 ' H ' ' HG2' ' A' ' 23' ' ' ARG . 15.6 m -126.3 148.1 49.6 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.768 -0.651 . . . . 62.1 109.877 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.8 t -146.94 -179.3 6.71 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.875 -0.417 . . . . 44.32 109.875 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 54.9 p-90 -84.71 -35.75 22.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.056 0.455 . . . . 74.22 110.573 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.425 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 3.3 ptm180 -81.0 -21.67 40.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.932 -0.576 . . . . 73.24 110.781 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -151.8 121.86 7.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.883 -0.599 . . . . 75.44 109.48 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.0 -41.69 90.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.307 -0.406 . . . . 74.41 111.345 -176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -122.71 109.24 14.0 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.159 0.504 . . . . 72.53 111.522 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.1 mm -79.04 105.8 8.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.744 -0.836 . . . . 42.44 108.744 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 47.6 p -87.75 -21.89 24.89 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.107 -0.497 . . . . 54.31 112.232 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 34' ' ' ARG . 7.0 ptp85 -66.34 131.77 46.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.074 0.464 . . . . 75.21 111.104 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -86.76 -179.77 6.62 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.921 -0.582 . . . . 74.43 110.258 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.64 -43.31 99.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.68 0.276 . . . . 72.5 110.986 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.58 -40.07 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 74.34 110.869 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.93 -36.49 64.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 73.44 110.715 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.42 94.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.101 -0.5 . . . . 34.14 110.769 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.97 -42.12 93.44 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.385 -0.37 . . . . 72.11 110.91 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -65.73 -42.36 91.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 31.41 110.973 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.43 -52.34 58.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 71.33 110.925 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.7 mm -53.45 -56.5 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 O-C-N 123.457 0.473 . . . . 64.14 111.848 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.582 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 51.0 m-80 -61.99 -36.67 82.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.714 0.292 . . . . 73.14 111.101 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -62.44 -47.03 92.43 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.862 -0.685 . . . . 71.32 111.926 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 50' ' ' ILE . 21.7 m-85 -57.38 -42.39 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.599 0.238 . . . . 74.5 110.907 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.47 -41.95 79.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.144 0.497 . . . . 41.32 110.505 178.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 71.8 mm-40 -66.73 -42.13 86.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.984 -0.553 . . . . 74.32 110.682 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.0 mtpp -58.92 -40.7 85.35 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.186 -0.461 . . . . 65.52 110.703 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 46' ' ' TYR . 82.3 mt -64.89 -42.87 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.703 -0.68 . . . . 74.32 110.996 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -69.09 -33.17 73.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.429 -0.351 . . . . 71.45 111.466 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -78.74 -16.03 57.71 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.01 0.434 . . . . 75.32 110.978 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.72 15.89 67.0 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.848 -0.691 . . . . 61.51 112.45 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -67.61 -58.29 4.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.21 0.529 . . . . 73.13 109.873 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -132.6 143.07 49.44 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.434 -0.803 . . . . 70.3 109.783 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -76.17 157.87 32.28 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 116.185 -0.461 . . . . 75.12 110.787 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -58.59 -43.9 89.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.506 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.387 -0.824 . . . . 70.15 110.488 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.3 t -65.24 -47.02 78.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.951 -0.568 . . . . 74.33 110.163 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.81 -37.16 81.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.004 -0.544 . . . . 70.01 111.075 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -65.53 -48.69 71.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.308 -0.406 . . . . 72.12 111.526 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -76.78 7.92 4.22 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.9 0.704 . . . . 42.23 112.9 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -135.6 -51.82 0.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.621 0.6 . . . . 71.4 112.621 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -96.27 -10.11 28.69 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.645 0.609 . . . . 64.44 112.645 -174.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 33.1 t -87.04 140.52 29.47 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.717 -0.393 . . . . 63.02 110.389 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.425 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 3.7 m-20 -93.46 13.71 20.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.996 0.427 . . . . 73.11 110.005 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 47.4 t -76.09 146.86 39.03 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.113 -0.494 . . . . 61.54 110.531 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.6 t -75.98 -20.49 57.83 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.854 -0.795 . . . . 73.23 108.854 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.38 -4.72 59.06 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.223 -0.899 . . . . 61.25 110.403 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.75 66.58 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.103 -0.499 . . . . 42.44 111.04 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -61.83 -26.48 68.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.967 -0.56 . . . . 73.24 110.608 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.73 24.44 8.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.941 -0.572 . . . . 65.2 110.135 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 68.2 13.71 9.12 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.911 -0.586 . . . . 72.12 111.274 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.71 12.01 78.48 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.576 -0.821 . . . . 62.02 111.848 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -65.88 126.17 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.923 0.392 . . . . 45.3 111.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -15.38 25.8 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.34 -0.615 . . . . 74.11 109.34 177.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.34 -166.56 48.03 Favored Glycine 0 N--CA 1.433 -1.561 0 C-N-CA 120.745 -0.74 . . . . 75.41 111.382 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -87.43 109.93 19.92 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.801 0.334 . . . . 62.31 110.261 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -116.06 151.36 35.68 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.135 -0.484 . . . . 71.34 109.993 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.402 ' OG ' ' HA ' ' A' ' 8' ' ' ARG . 13.4 m -149.81 177.48 9.77 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.586 -0.279 . . . . 75.54 111.124 -177.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 67.17 10.75 7.95 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.529 -0.759 . . . . 63.32 112.38 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 67.71 31.85 76.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.032 -0.604 . . . . 72.31 112.882 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -82.26 79.05 8.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.155 0.502 . . . . 75.15 110.678 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.5 tpp -178.26 164.0 1.71 Allowed 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.964 -1.016 . . . . 60.2 108.376 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -58.0 139.72 53.88 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.573 0.225 . . . . 74.3 110.572 177.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 53.0 tptt -55.02 -48.63 95.56 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 113.113 0.782 . . . . 62.34 113.113 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 61.1 Cg_exo -53.12 -37.89 80.13 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 121.97 1.78 . . . . 71.04 111.874 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -76.26 -43.79 40.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.42 -0.809 . . . . 74.32 109.707 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.74 -50.21 74.71 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.668 -0.697 . . . . 71.12 111.472 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -54.6 -32.45 58.74 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.958 -0.564 . . . . 73.01 111.867 -177.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -86.77 -42.18 13.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.473 -0.33 . . . . 75.54 111.407 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -64.9 -44.85 88.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.96 0.409 . . . . 75.43 111.66 -177.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -79.13 -0.79 33.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.304 -0.407 . . . . 53.04 111.34 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.63 -2.9 24.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.138 -0.483 . . . . 21.54 110.298 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.3 mt -84.5 140.8 31.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.062 -0.517 . . . . 73.41 110.778 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.99 -174.61 3.02 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.847 -0.615 . . . . 74.11 109.59 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.5 m -72.88 100.9 3.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.933 0.397 . . . . 74.5 110.449 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.23 19.77 20.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.879 -0.677 . . . . 52.3 111.771 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -104.84 147.29 27.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.831 0.348 . . . . 53.31 110.694 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' MET . . . . . 0.424 ' SD ' HD12 ' A' ' 114' ' ' LEU . 56.4 ttp -133.4 135.28 44.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.038 -0.528 . . . . 71.0 110.203 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.478 ' HB2' HD21 ' A' ' 95' ' ' LEU . 16.5 t -92.86 161.62 14.42 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.526 -0.546 . . . . 33.21 109.526 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.11 -144.25 6.89 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 120.648 -0.786 . . . . 64.03 112.19 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.4 103.62 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.501 2.134 . . . . 72.21 112.427 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.72 107.08 19.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.76 -0.459 . . . . 75.25 109.76 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -73.28 112.32 9.23 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.195 0.521 . . . . 71.32 111.037 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 107' ' ' ASP . 1.9 m -120.85 169.47 10.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.588 -0.733 . . . . 54.43 109.48 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.442 ' H ' HG22 ' A' ' 106' ' ' THR . 1.9 m-20 -51.71 -46.45 63.95 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.694 0.627 . . . . 63.12 112.694 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 p -77.7 -16.43 58.48 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.552 0.575 . . . . 54.54 112.552 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 146.15 -158.36 27.67 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.514 -0.851 . . . . 51.21 111.773 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 34.6 mt -87.73 126.2 41.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 120.858 0.361 . . . . 74.22 110.423 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.478 ' CD2' HD13 ' A' ' 15' ' ' LEU . 14.4 m-70 -115.23 133.35 56.11 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.107 -0.497 . . . . 73.13 110.274 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 42.3 mt -101.2 124.34 54.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 N-CA-C 107.606 -1.257 . . . . 70.51 107.606 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.1 mt -112.74 132.78 60.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 C-N-CA 120.813 -0.355 . . . . 75.33 111.32 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.424 HD12 ' SD ' ' A' ' 100' ' ' MET . 8.5 tt -133.65 131.39 39.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.193 -0.458 . . . . 64.43 109.983 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -118.69 130.26 55.74 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.922 -0.399 . . . . 64.32 109.922 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.33 0.57 14.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.858 0.318 . . . . 74.11 111.858 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 118.438 -0.791 . . . . 41.41 110.831 -178.897 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.607 0 CA-C-O 121.106 0.479 . . . . 64.01 109.732 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -133.0 127.41 34.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.404 -0.816 . . . . 64.12 109.912 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.9 m -131.9 166.75 28.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 116.328 -0.397 . . . . 44.45 110.029 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.429 ' H ' ' HB2' ' A' ' 117' ' ' GLU . 58.5 ttt180 -123.75 128.28 49.35 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.699 0.285 . . . . 74.34 110.867 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -134.32 138.72 45.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.856 -0.611 . . . . 62.44 110.518 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.4 m -96.92 158.29 15.5 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.563 -1.273 . . . . 55.52 107.563 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.424 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 10.0 p-80 -147.72 139.34 23.88 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.366 0.876 . . . . 64.02 113.366 -172.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD23 HD12 ' A' ' 112' ' ' ILE . 56.5 tp -116.72 116.48 27.6 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.155 -0.93 . . . . 73.44 108.762 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.672 HD13 ' CE1' ' A' ' 111' ' ' HIS . 16.3 tp -109.66 125.28 52.45 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.888 0.375 . . . . 73.44 110.967 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 p -123.92 136.12 61.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.626 -0.716 . . . . 61.23 109.85 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -84.71 179.7 7.3 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.457 0.646 . . . . 73.23 111.501 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.4 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 6.2 p80 -148.65 153.8 38.8 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.184 -0.917 . . . . 73.15 109.005 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.0 t -44.02 -51.82 7.53 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.997 0.81 . . . . 73.43 112.583 -176.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -90.08 65.31 6.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.092 0.473 . . . . 65.3 111.115 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -110.11 168.8 9.17 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.972 -0.558 . . . . 54.12 109.728 177.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -69.8 -24.92 63.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.159 0.504 . . . . 72.3 110.189 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -153.55 88.8 3.61 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.811 -0.632 . . . . 63.01 109.343 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.5 56.53 6.12 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 123.042 2.495 . . . . 61.43 112.546 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.5 m -137.33 125.23 22.66 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.303 -0.408 . . . . 73.11 110.344 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.5 m -127.4 176.79 7.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.761 0.315 . . . . 61.42 111.622 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -66.99 -31.14 71.51 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.452 0.538 . . . . 65.55 112.452 -178.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -86.61 -62.11 1.58 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.169 0.509 . . . . 73.42 109.791 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -112.35 127.61 56.05 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.809 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -82.01 -14.06 56.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.98 -0.555 . . . . 45.43 110.772 -178.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -123.58 139.44 54.0 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 65.13 109.429 176.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.09 102.26 13.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.958 0.408 . . . . 72.43 110.703 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.1 p -81.43 -41.6 21.61 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.943 -0.571 . . . . 53.14 110.301 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.514 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 8.4 ptt85 -53.09 117.54 3.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.504 -0.771 . . . . 74.12 111.964 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.3 t -82.37 -179.25 7.35 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.872 -0.604 . . . . 65.35 110.639 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -41.11 87.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 63.21 111.065 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.03 -45.47 94.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.421 -0.354 . . . . 72.44 111.051 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 47.5 mt-10 -65.69 -41.62 92.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.06 -0.518 . . . . 74.11 110.434 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.436 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -65.5 -35.77 81.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 72.03 111.148 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.63 -44.49 93.46 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.083 0.468 . . . . 74.5 109.815 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.84 -36.59 80.61 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.84 -0.618 . . . . 62.1 110.208 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.8 mt -62.2 -42.01 98.89 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.321 -0.4 . . . . 75.02 110.048 178.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 39' ' ' ALA . 31.6 mm -54.8 -54.43 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 116.224 -0.444 . . . . 74.02 110.201 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -60.66 -38.35 84.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.771 -0.65 . . . . 71.31 110.373 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -46.92 93.53 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.859 -0.61 . . . . 64.44 111.882 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.2 m-85 -61.39 -50.43 72.91 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.862 -0.422 . . . . 72.41 109.862 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.79 -48.94 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.816 -0.629 . . . . 52.31 111.165 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -39.61 89.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.257 -0.429 . . . . 70.13 111.27 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.48 ' HG3' ' OE1' ' A' ' 54' ' ' GLU . 41.9 tttp -67.27 -36.08 80.83 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 120.899 0.381 . . . . 64.31 110.73 -179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.516 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 91.4 mt -65.28 -47.05 88.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.552 -0.536 . . . . 71.44 109.552 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.77 -15.01 63.39 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.703 -0.681 . . . . 72.23 111.538 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.4 m -80.04 -11.77 59.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.952 0.406 . . . . 72.05 110.411 177.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.16 18.38 74.57 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.788 -0.72 . . . . 65.21 112.01 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE1' ' HG3' ' A' ' 49' ' ' LYS . 48.1 mt-10 -88.9 -68.35 0.78 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.107 0.479 . . . . 74.51 109.811 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 73.8 mm-40 -108.37 147.52 31.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.767 -0.652 . . . . 73.11 109.903 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -93.71 157.52 16.12 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.183 -0.673 . . . . 53.23 109.183 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -36.29 63.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.002 0.43 . . . . 64.15 110.814 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -60.76 -34.81 75.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.736 -0.665 . . . . 72.54 111.093 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.7 t -69.19 -44.76 71.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.171 0.51 . . . . 73.15 109.974 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.81 -45.81 80.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.741 -0.663 . . . . 61.53 110.531 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -70.24 -17.8 63.14 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.892 0.701 . . . . 43.31 112.892 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.7 m -99.01 -24.2 15.0 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.719 0.637 . . . . 64.02 112.719 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -121.27 -28.3 4.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.136 0.791 . . . . 71.13 113.136 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -105.81 5.2 30.6 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.114 0.413 . . . . 74.44 112.114 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -90.97 140.63 29.66 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.654 -0.418 . . . . 71.45 109.946 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -88.8 -1.4 58.07 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.205 0.526 . . . . 64.42 110.559 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB2' HD23 ' A' ' 15' ' ' LEU . 46.9 t -87.5 154.57 20.53 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.956 -0.566 . . . . 53.3 110.474 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 m -74.87 -9.05 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.415 0.626 . . . . 74.31 109.882 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.9 p -74.2 -5.78 43.95 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.499 -0.773 . . . . 74.13 110.93 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -29.0 68.87 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.041 -0.527 . . . . 44.03 109.99 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -68.98 -26.63 65.12 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.539 -0.755 . . . . 64.12 110.3 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.54 16.06 5.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.165 -0.471 . . . . 42.55 110.298 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.0 ttt85 69.0 17.53 8.57 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.601 -0.727 . . . . 75.55 110.434 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.605 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 69.31 29.27 71.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.613 -0.721 . . . . 61.12 113.137 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -124.94 135.31 52.71 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 122.614 -0.345 . . . . 74.12 110.943 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.5 mt -91.35 -11.22 38.53 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.302 -178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.77 -158.18 49.73 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.405 -0.902 . . . . 33.33 110.908 -176.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.9 117.44 27.9 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.84 0.352 . . . . 52.11 110.505 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -118.06 166.49 12.48 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 109.664 -0.495 . . . . 73.1 109.664 178.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -96.23 170.8 9.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.047 0.451 . . . . 72.22 111.243 -177.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -69.93 132.04 45.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.604 -0.725 . . . . 71.53 110.919 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.42 39.79 25.18 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.918 -0.658 . . . . 70.23 112.126 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -123.62 -4.69 8.19 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.158 0.429 . . . . 74.01 112.158 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 35.4 tpp -125.89 173.96 8.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.666 -0.414 . . . . 54.42 111.29 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -54.55 145.33 18.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.475 -0.33 . . . . 75.11 110.789 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 27.2 tptp -48.39 -54.46 25.7 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 113.457 0.91 . . . . 71.32 113.457 -176.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 29.4 Cg_endo -62.41 -26.79 76.9 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.12 1.88 . . . . 64.13 112.761 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -84.8 -43.23 14.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.144 0.497 . . . . 73.52 109.706 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.5 -50.98 70.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.063 -0.971 . . . . 73.33 110.922 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.18 -48.61 77.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.644 -0.707 . . . . 65.53 111.558 -178.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.72 77.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.186 -0.461 . . . . 72.1 112.043 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.45 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 71.7 m -59.04 -50.82 72.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.776 0.322 . . . . 63.45 111.459 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -79.2 -16.55 56.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.543 -0.299 . . . . 72.44 111.677 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.44 62.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.159 0.504 . . . . 43.22 109.73 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.7 mt -84.71 -171.38 3.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.566 -0.743 . . . . 74.44 109.9 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -148.09 -178.88 6.53 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.178 -0.675 . . . . 75.13 109.178 177.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 116' ' ' THR . 32.5 m -54.53 113.04 1.14 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.595 0.358 . . . . 74.45 111.957 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 97.36 -6.56 63.45 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.935 -0.65 . . . . 61.04 113.621 175.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -90.99 149.7 21.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.146 0.498 . . . . 61.2 111.863 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.6 ttp -131.05 131.51 44.3 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.474 -0.785 . . . . 71.03 110.323 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 95' ' ' LEU . 28.2 t -87.21 168.29 13.35 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.685 -0.487 . . . . 74.21 109.685 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.57 -137.28 5.86 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.804 -0.712 . . . . 73.43 112.532 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.21 108.95 2.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.728 2.285 . . . . 63.0 113.388 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 74.4 t -102.97 104.79 17.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.258 -0.645 . . . . 54.04 109.258 175.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -76.11 122.88 24.93 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.262 -0.426 . . . . 75.32 111.445 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.517 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.6 OUTLIER -127.42 -152.77 0.53 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 116.137 -0.483 . . . . 61.44 109.99 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.517 ' H ' HG22 ' A' ' 106' ' ' THR . 8.7 m-20 -71.4 -65.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.947 0.351 . . . . 75.15 111.947 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 43.3 t -64.15 -42.92 96.58 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.113 -0.494 . . . . 72.35 111.729 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.4 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . -179.28 -145.02 6.05 Favored Glycine 0 N--CA 1.436 -1.312 0 C-N-CA 120.179 -1.01 . . . . 70.25 112.512 -178.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.8 mt -96.54 137.95 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 110.171 -0.307 . . . . 75.1 110.171 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.672 ' CE1' HD13 ' A' ' 15' ' ' LEU . 7.1 m80 -119.59 130.64 55.22 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.396 -0.365 . . . . 62.3 110.826 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.672 HD12 HD23 ' A' ' 14' ' ' LEU . 24.6 mt -101.28 130.88 50.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 107.648 -1.242 . . . . 61.25 107.648 172.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.0 120.24 62.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 112.095 0.406 . . . . 74.54 112.095 -175.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.6 tp -112.84 109.53 19.06 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.971 -0.751 . . . . 73.23 108.971 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 92' ' ' SER . 80.0 ttt180 -85.39 114.87 22.77 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.584 -0.446 . . . . 73.23 110.793 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 97' ' ' THR . 6.9 m -84.16 -44.65 13.77 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.913 -0.585 . . . . 73.44 110.425 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.429 ' HB2' ' H ' ' A' ' 10' ' ' ARG . 32.1 mm-40 . . . . . 0 C--O 1.243 0.726 0 CA-C-O 118.38 -0.819 . . . . 74.42 110.512 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.571 -0.529 . . . . 54.23 109.571 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -125.73 113.42 17.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 73.43 109.418 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.8 m -111.83 148.4 15.04 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 116.386 -0.37 . . . . 54.03 110.901 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -126.18 129.15 48.44 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.289 -0.414 . . . . 74.04 110.103 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.9 155.57 47.97 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.754 -0.657 . . . . 64.44 110.345 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.2 m -98.35 142.48 29.93 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.973 -1.121 . . . . 74.41 107.973 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.417 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 7.9 p-80 -127.24 129.99 48.79 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.887 0.699 . . . . 71.32 112.887 -175.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HB3' ' HB ' ' A' ' 112' ' ' ILE . 2.9 tm? -105.71 127.32 53.01 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 106.491 -1.67 . . . . 63.25 106.491 175.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.528 HD11 ' O ' ' A' ' 108' ' ' SER . 38.3 tp -125.56 121.08 32.62 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.641 -0.424 . . . . 65.34 111.286 -178.127 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -137.18 130.81 44.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.507 -0.769 . . . . 65.01 109.729 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 23' ' ' ARG . 51.0 mttp -97.16 -179.97 4.71 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.165 -0.471 . . . . 74.12 111.206 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -153.5 -179.26 7.6 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.447 -0.575 . . . . 65.12 109.447 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 p -48.13 -46.15 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.598 0.561 . . . . 75.14 111.843 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -85.34 69.1 10.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.113 0.483 . . . . 75.03 111.51 178.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.9 t -144.99 157.78 44.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.068 -0.716 . . . . 71.24 109.068 176.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.88 -19.54 60.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.94 0.4 . . . . 75.44 111.308 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.41 ' O ' ' HD3' ' A' ' 17' ' ' LYS . 32.6 tpt180 -123.78 94.94 45.28 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.31 -0.404 . . . . 75.24 110.321 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -91.53 28.4 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 123.083 2.522 . . . . 60.33 112.67 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -143.27 128.93 19.23 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.407 -0.36 . . . . 61.23 110.336 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.37 -168.72 1.85 Allowed 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.098 -0.334 . . . . 74.42 110.098 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 66.8 p-90 -86.26 -16.65 36.94 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.026 0.441 . . . . 73.11 110.006 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -100.41 -37.95 8.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 71.31 110.809 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -131.94 117.36 18.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.489 -0.56 . . . . 71.21 109.489 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 63.23 111.888 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -134.24 101.18 4.92 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.045 0.45 . . . . 62.41 110.509 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.18 93.17 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.993 -0.549 . . . . 73.13 110.173 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.9 p -88.8 -16.88 30.98 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.049 -0.523 . . . . 74.43 111.608 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -67.16 124.82 24.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.264 0.554 . . . . 71.31 111.815 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.2 t -84.28 -177.53 6.67 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.72 -0.673 . . . . 60.33 110.923 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -57.82 -42.02 83.44 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 122.794 0.438 . . . . 73.43 111.021 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -57.67 -44.17 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.1 111.328 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 27.1 mm-40 -69.7 -42.16 74.44 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.878 -0.601 . . . . 70.53 110.449 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.51 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.01 -44.24 97.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.662 -0.699 . . . . 72.24 111.482 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -58.47 -45.47 88.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.538 -0.301 . . . . 61.32 111.609 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -61.44 -34.02 74.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.894 0.378 . . . . 75.22 110.816 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.9 mt -72.29 -41.81 66.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.015 -0.539 . . . . 74.41 110.019 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.0 mm -58.65 -47.07 89.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.135 -0.484 . . . . 74.02 109.815 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.549 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 85.8 m-20 -57.48 -43.65 84.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 115.723 -0.672 . . . . 64.24 109.927 178.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.6 -41.28 97.24 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.722 -0.672 . . . . 74.23 112.243 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -61.94 -48.83 78.67 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 109.518 -0.549 . . . . 71.53 109.518 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.83 -42.96 87.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.368 -0.833 . . . . 74.11 110.702 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 81.3 mm-40 -58.52 -48.06 82.1 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 116.299 -0.41 . . . . 73.41 110.902 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -59.54 -41.78 90.83 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.894 0.331 . . . . 42.04 111.894 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 71.9 mt -72.22 -41.47 66.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 74.12 111.844 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -78.11 -40.07 39.37 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 72.03 112.373 -178.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.0 t -73.97 -26.3 60.4 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.596 0.236 . . . . 74.21 110.878 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.44 38.54 5.58 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.573 -0.822 . . . . 54.21 112.074 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.69 -49.55 7.07 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 72.1 110.226 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -143.38 173.7 11.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.787 -0.642 . . . . 63.11 110.305 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -99.15 153.97 18.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.136 -0.484 . . . . 71.04 110.215 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -55.52 -38.16 68.86 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.005 0.431 . . . . 54.41 110.264 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.509 ' OE2' ' HD2' ' A' ' 73' ' ' ARG . 35.5 mt-10 -61.68 -30.67 70.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.644 -0.707 . . . . 72.45 111.283 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.8 t -76.67 -28.93 56.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.347 0.594 . . . . 74.51 110.453 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -87.84 -47.94 8.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.781 -0.645 . . . . 64.31 111.081 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -19.98 64.03 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.925 0.713 . . . . 71.12 112.925 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.686 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 2.7 p -76.65 -20.79 56.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.196 0.813 . . . . 72.32 113.196 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -128.77 -22.53 3.24 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.931 0.715 . . . . 74.52 112.931 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -91.56 -10.85 39.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.658 0.614 . . . . 72.42 112.658 -177.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 34.3 m -84.41 136.21 33.96 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.998 -0.281 . . . . 61.3 110.244 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -84.96 -11.8 54.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.306 0.574 . . . . 53.02 109.913 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.466 ' HB2' HD23 ' A' ' 15' ' ' LEU . 30.9 t -79.6 159.7 26.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.317 -0.856 . . . . 74.02 110.89 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 17.0 m -70.05 -19.0 63.31 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.161 -0.472 . . . . 64.55 110.138 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.9 m -67.67 -5.03 13.87 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.969 -0.56 . . . . 64.13 111.421 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -51.99 -51.15 59.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.185 -0.461 . . . . 74.32 111.285 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.88 4.44 9.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.116 0.413 . . . . 64.05 112.116 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.3 12.34 37.33 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.964 -0.754 . . . . 71.32 108.964 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.509 ' HD2' ' OE2' ' A' ' 58' ' ' GLU . 75.9 mtm180 69.33 16.4 8.36 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.791 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.49 3.43 90.53 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.002 -0.618 . . . . 70.42 113.316 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -73.72 134.6 43.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.085 0.469 . . . . 71.43 111.025 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.518 ' O ' HD23 ' A' ' 76' ' ' LEU . 4.1 tt -101.69 -19.64 15.32 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.782 -0.821 . . . . 75.03 108.782 178.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.44 -176.38 48.2 Favored Glycine 0 N--CA 1.437 -1.272 0 CA-C-N 115.56 -0.745 . . . . 63.13 111.628 -178.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.04 131.98 34.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 120.748 0.309 . . . . 75.2 110.235 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -133.27 154.44 50.68 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.913 -0.585 . . . . 72.34 110.02 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 p -95.56 -80.85 0.41 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 111.989 0.366 . . . . 72.31 111.989 -177.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -161.64 136.97 7.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 72.31 110.842 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.57 15.93 76.87 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.748 -0.66 . . . . 74.31 111.474 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -103.87 -36.38 7.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 71.45 110.824 -176.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.5 tpp -121.23 157.56 30.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.205 -0.452 . . . . 72.13 109.996 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -48.03 135.7 12.43 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 123.38 0.425 . . . . 73.41 111.464 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.499 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 12.7 tmtt? -48.6 -52.48 44.11 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 115.64 -0.709 . . . . 50.24 112.635 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.1 Cg_endo -53.54 -24.14 27.78 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.619 2.212 . . . . 50.12 113.413 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.561 ' CD2' HG12 ' A' ' 113' ' ' ILE . 31.1 t80 -99.42 -53.36 3.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.056 0.455 . . . . 74.32 110.586 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -59.86 -48.08 83.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.52 -0.764 . . . . 60.53 111.386 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -60.76 -45.09 95.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.115 -0.493 . . . . 73.42 111.683 -178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.92 66.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 51.52 111.351 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -65.84 -24.16 66.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.237 -0.438 . . . . 45.52 111.668 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -81.84 -27.51 33.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.412 . . . . 73.02 110.542 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.61 -28.08 37.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.863 -0.608 . . . . 73.45 110.887 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.41 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -82.68 133.22 35.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.067 -0.515 . . . . 74.12 110.546 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -97.09 169.41 9.83 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.322 -0.399 . . . . 64.03 109.97 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.9 m -55.89 111.28 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.302 -0.408 . . . . 62.04 111.158 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.31 -13.28 23.54 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.692 -0.766 . . . . 42.21 112.691 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -91.0 154.63 19.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.908 0.385 . . . . 72.2 110.958 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.8 ttp -142.23 130.23 21.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.127 -0.488 . . . . 74.11 110.427 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.41 ' HB2' HD11 ' A' ' 95' ' ' LEU . 38.0 t -78.86 157.46 28.32 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.075 -0.512 . . . . 73.4 110.321 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.18 -155.88 22.78 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.811 -0.709 . . . . 72.1 111.776 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.02 105.73 1.41 Allowed 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.636 2.224 . . . . 74.44 113.232 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.2 110.8 21.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.921 -0.77 . . . . 74.24 108.921 175.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -83.92 122.47 28.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.214 -0.448 . . . . 63.52 111.937 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.5 p -142.45 178.57 7.51 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.793 -0.639 . . . . 73.55 109.779 178.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.21 -31.98 70.94 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.036 0.446 . . . . 73.55 110.865 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.528 ' O ' HD11 ' A' ' 15' ' ' LEU . 11.8 p -79.74 4.97 14.66 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.63 -0.713 . . . . 75.24 111.33 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.85 -158.44 14.28 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.845 -0.693 . . . . 70.01 112.389 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.4 mt -97.93 128.12 49.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 N-CA-C 109.837 -0.431 . . . . 74.23 109.837 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -110.9 125.54 53.76 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.496 -0.32 . . . . 75.24 110.812 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.466 ' HB ' ' HB3' ' A' ' 14' ' ' LEU . 59.0 mt -102.17 130.67 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.458 -0.942 . . . . 54.14 108.458 174.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' CD2' ' A' ' 88' ' ' PHE . 11.0 mt -110.79 107.43 22.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.652 -0.249 . . . . 73.01 111.202 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.9 tt -104.75 114.81 29.25 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.174 -0.676 . . . . 71.44 109.174 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -79.39 108.39 12.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.222 -0.444 . . . . 71.51 110.261 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.2 p -95.07 -64.07 1.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.644 0.979 . . . . 75.53 113.644 -176.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.344 -0.836 . . . . 74.42 111.765 -174.901 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 121.292 0.568 . . . . 70.34 109.877 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.6 mtt180 -107.07 117.51 34.26 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.257 -0.883 . . . . 74.24 110.021 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.3 m -124.54 148.66 28.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 CA-C-N 116.165 -0.471 . . . . 73.24 110.366 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.4 ttt180 -103.54 109.06 20.58 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 110.043 -0.355 . . . . 70.12 110.043 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.8 m -128.88 132.78 47.74 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.299 0.571 . . . . 74.14 111.318 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 6.8 m -98.1 142.77 29.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 108.247 -1.02 . . . . 54.52 108.247 176.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.493 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -133.91 129.06 35.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.452 0.908 . . . . 64.35 113.452 -176.58 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.4 tt -106.78 142.61 36.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 107.645 -1.243 . . . . 75.24 107.645 174.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.545 HD23 ' HB2' ' A' ' 67' ' ' SER . 46.0 tp -123.75 134.05 53.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.883 0.327 . . . . 75.53 111.883 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.414 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 14.4 p -117.64 132.62 66.93 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-N 115.758 -0.655 . . . . 70.13 109.944 175.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.89 158.24 16.88 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.956 0.408 . . . . 73.34 110.171 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -139.98 158.25 44.36 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.11 -0.496 . . . . 75.12 109.735 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.2 t -43.76 -59.88 2.04 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.98 0.8 . . . . 74.43 112.356 -177.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -92.02 66.84 5.04 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.053 0.454 . . . . 71.34 111.12 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 t -116.0 173.74 6.41 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.067 -0.515 . . . . 75.1 109.621 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -56.51 -57.21 13.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 53.3 109.879 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -126.55 97.96 32.69 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 109.37 -0.604 . . . . 72.55 109.37 175.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -73.73 50.57 2.09 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.387 2.725 . . . . 60.3 112.295 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -140.82 152.39 45.13 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 116.038 -0.528 . . . . 53.22 110.172 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.3 p -154.99 -176.4 5.92 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.358 -0.608 . . . . 60.35 109.358 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -82.64 -3.38 56.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.352 0.596 . . . . 72.33 109.589 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 58.9 mtp180 -104.99 -43.64 5.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.791 . . . . 74.22 110.078 -178.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.448 ' HB3' HD13 ' A' ' 32' ' ' ILE . 62.8 tt0 -142.92 118.34 10.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.866 -0.606 . . . . 74.23 109.894 -178.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.36 -29.27 63.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.926 0.393 . . . . 70.25 111.164 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -123.1 94.11 4.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.232 0.539 . . . . 74.52 110.241 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 29' ' ' GLN . 42.6 mm -68.73 104.01 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.501 -0.772 . . . . 53.14 111.39 -178.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.54 -24.07 20.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.044 -0.525 . . . . 74.21 111.001 177.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HG2' ' H ' ' A' ' 34' ' ' ARG . 4.5 ptt180 -60.64 118.22 6.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.898 -0.592 . . . . 75.4 110.303 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t -85.15 -174.72 5.4 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.767 -0.651 . . . . 74.53 112.098 -175.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -57.58 -50.62 72.52 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.559 -0.746 . . . . 70.02 111.482 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -52.2 -44.01 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.207 -0.451 . . . . 65.55 111.295 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.562 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 38.8 mt-10 -67.55 -51.14 54.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.9 -0.591 . . . . 72.14 110.694 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.1 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.02 -0.536 . . . . 51.22 111.145 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.0 tp -61.93 -44.3 97.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 71.11 110.722 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -70.27 -33.82 72.04 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.416 -0.356 . . . . 71.15 111.097 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.6 mt -62.3 -48.35 80.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.988 -0.375 . . . . 72.21 109.988 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.468 HG23 HG12 ' A' ' 112' ' ' ILE . 29.6 mm -54.08 -60.49 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-N 115.772 -0.649 . . . . 73.23 111.302 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -63.8 -28.91 70.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 74.21 111.0 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.479 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -64.43 -54.72 27.58 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 111.609 -0.597 . . . . 70.22 111.609 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.46 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.3 m-85 -56.73 -45.15 82.13 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.005 -0.368 . . . . 72.23 110.005 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.465 ' CD1' ' HA2' ' A' ' 102' ' ' GLY . 78.6 mt -54.98 -47.76 76.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.798 -0.637 . . . . 51.15 110.843 178.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -64.61 -40.13 94.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 63.41 110.756 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.3 mtpp -64.39 -39.83 94.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.96 0.409 . . . . 74.2 110.692 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 46' ' ' TYR . 88.4 mt -68.87 -46.91 78.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.637 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -62.17 -29.08 70.11 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.307 -0.406 . . . . 72.54 112.04 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 m -77.41 -9.04 58.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.828 0.347 . . . . 72.12 110.76 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 3.33 83.35 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.002 -0.618 . . . . 75.33 112.288 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -73.78 -62.54 1.46 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.992 0.425 . . . . 63.43 110.783 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HG3' ' HE3' ' A' ' 49' ' ' LYS . 24.3 mm-40 -101.92 167.15 10.24 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.066 -0.516 . . . . 72.11 110.682 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -119.66 140.41 50.67 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.531 -0.544 . . . . 53.45 109.531 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -57.32 -55.6 32.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.8 0.296 . . . . 63.43 111.8 -177.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.405 ' OE2' ' HD3' ' A' ' 73' ' ' ARG . 47.8 mt-10 -53.14 -42.52 66.16 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.686 0.279 . . . . 75.31 111.351 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.6 m -64.39 -47.28 79.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.294 -0.412 . . . . 72.35 110.93 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.89 -43.29 79.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 74.12 111.016 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.618 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -68.53 -10.85 58.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.142 -0.481 . . . . 75.22 112.273 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.481 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 70.5 m -88.38 -13.19 41.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.775 0.322 . . . . 75.45 111.267 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -128.62 -36.41 1.85 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.7 0.63 . . . . 64.52 112.7 -177.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.81 9.1 38.59 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.4 0.518 . . . . 73.5 112.4 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -92.09 114.45 26.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.708 -0.397 . . . . 65.31 110.06 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.452 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 59.5 m-20 -78.76 51.3 1.08 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.256 0.55 . . . . 61.35 110.781 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.545 ' HB2' HD23 ' A' ' 15' ' ' LEU . 26.0 t -164.61 178.19 7.51 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.676 -0.693 . . . . 71.24 109.355 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -67.06 -14.06 62.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.97 0.414 . . . . 51.43 110.713 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.5 m -56.11 -24.77 42.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.738 -0.665 . . . . 75.01 111.024 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.618 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -61.11 -30.29 70.27 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.923 -0.58 . . . . 62.35 111.725 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -83.44 -11.46 57.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.063 0.459 . . . . 71.11 111.043 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.48 13.81 18.94 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.205 -0.452 . . . . 70.44 111.248 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.405 ' HD3' ' OE2' ' A' ' 58' ' ' GLU . 83.2 mtt180 64.03 11.19 5.94 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.305 -0.407 . . . . 75.24 111.724 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.39 -25.08 3.35 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 121.053 -0.594 . . . . 62.45 112.606 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 13.0 t0 -77.91 126.61 31.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.063 0.459 . . . . 75.22 111.421 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -103.42 -4.75 23.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.726 -0.67 . . . . 70.35 110.776 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 78.13 -165.32 51.96 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.194 -1.003 . . . . 70.35 110.924 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.22 119.26 22.75 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.877 -0.416 . . . . 72.31 109.877 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 29.4 p90 -127.4 162.7 25.7 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.229 -0.442 . . . . 72.52 110.83 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.9 t -82.94 135.63 34.83 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.93 -0.577 . . . . 73.31 109.816 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.401 ' HD3' ' CZ ' ' A' ' 93' ' ' PHE . 31.0 ptt180 -57.35 -31.49 65.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.898 -0.592 . . . . 74.02 111.939 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.82 73.1 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.662 -0.78 . . . . 53.05 112.222 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.6 16.37 17.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.957 0.408 . . . . 71.54 109.966 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.2 tpp -130.39 154.18 47.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.04 -0.527 . . . . 73.43 110.635 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' OE1' ' HA ' ' A' ' 85' ' ' GLN . 16.0 mm-40 -60.46 144.26 51.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.529 -0.305 . . . . 62.32 110.566 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.477 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 48.2 tptt -59.46 -50.4 87.43 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 113.093 0.775 . . . . 72.23 113.093 -176.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 16.9 Cg_endo -58.76 -35.43 98.64 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 121.79 1.66 . . . . 75.21 111.445 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -68.57 -44.37 74.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.582 -0.736 . . . . 73.43 109.174 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.46 -48.59 80.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.605 -0.725 . . . . 71.4 110.158 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -55.58 -42.77 75.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.503 -0.771 . . . . 63.04 111.4 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -70.99 -40.7 71.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.327 -0.397 . . . . 71.15 110.91 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 m -62.87 -45.22 93.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.039 0.447 . . . . 63.53 111.328 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.401 ' CZ ' ' HD3' ' A' ' 81' ' ' ARG . 13.1 m-85 -78.65 -6.24 55.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.098 -0.501 . . . . 74.51 111.587 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.67 -26.3 21.92 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.252 -0.647 . . . . 74.32 109.252 175.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 101' ' ' SER . 91.0 mt -86.43 179.71 6.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.195 -0.911 . . . . 73.33 110.787 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -130.21 176.65 7.93 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.548 -0.751 . . . . 74.24 109.542 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.4 m -61.05 110.16 1.28 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.012 0.434 . . . . 64.45 111.035 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.39 16.22 32.74 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 121.023 -0.608 . . . . 55.41 112.502 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -109.72 148.17 31.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.849 0.357 . . . . 72.44 111.237 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.3 ttp -128.63 127.96 43.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.027 -0.533 . . . . 65.04 110.473 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.454 ' HB2' HD11 ' A' ' 95' ' ' LEU . 32.1 t -83.05 161.42 21.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.031 -0.531 . . . . 63.25 110.823 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.465 ' HA2' ' CD1' ' A' ' 47' ' ' ILE . . . -84.98 -139.02 4.47 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 115.938 -0.574 . . . . 44.23 112.405 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.58 106.15 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.821 2.347 . . . . 72.11 112.665 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.96 123.24 67.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.483 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -97.12 124.75 41.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.2 -0.455 . . . . 71.01 109.872 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.2 p -113.5 -60.56 1.87 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.364 0.505 . . . . 51.21 112.364 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -144.57 -53.01 0.31 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.382 0.512 . . . . 71.31 112.382 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 m -113.53 -53.67 2.67 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.944 0.35 . . . . 74.23 111.944 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.38 -169.38 12.61 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 119.973 -1.108 . . . . 63.05 112.733 -177.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.7 mt -90.78 138.49 19.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.501 -0.555 . . . . 73.13 109.501 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.543 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 72.9 m-70 -119.89 145.31 46.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.765 0.317 . . . . 61.14 111.373 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 50.0 mt -100.95 117.35 46.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.469 -1.308 . . . . 74.11 107.469 173.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 62.6 mt -103.72 110.9 31.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 120.92 0.39 . . . . 73.51 111.724 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.8 tp -106.09 107.4 18.38 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.815 -0.63 . . . . 72.43 109.842 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -85.19 100.22 11.61 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.686 -0.487 . . . . 74.13 109.686 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.2 m -74.15 -38.18 63.8 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.686 -0.688 . . . . 74.24 110.56 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.257 1.447 0 CA-C-O 118.518 -0.753 . . . . 73.21 110.318 -178.714 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 121.17 0.51 . . . . 63.34 110.214 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -113.24 127.04 56.04 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.602 -0.727 . . . . 72.02 109.784 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.1 m -125.58 143.65 38.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 CA-C-N 116.263 -0.426 . . . . 72.34 110.514 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 60.6 ttt180 -112.27 122.92 49.08 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.623 -0.51 . . . . 55.12 109.623 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -134.53 167.64 20.42 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.101 0.476 . . . . 52.53 111.049 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -122.37 145.33 48.37 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.486 -0.931 . . . . 53.12 108.486 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -124.06 129.44 50.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.448 -0.501 . . . . 74.14 112.304 -176.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.652 HD23 HD12 ' A' ' 112' ' ' ILE . 38.4 tp -106.2 119.11 38.37 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 108.506 -0.924 . . . . 74.22 108.506 176.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.62 HD13 ' NE2' ' A' ' 111' ' ' HIS . 13.8 tp -116.84 120.17 37.68 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.15 0.5 . . . . 63.02 111.326 -178.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.7 t -118.47 105.92 18.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.0 -1.0 . . . . 74.14 108.312 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -76.48 168.85 19.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.497 0.665 . . . . 73.2 111.803 -177.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.437 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 2.0 p80 -139.26 156.26 47.19 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.134 -0.939 . . . . 64.41 109.828 -178.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 p -51.34 -38.02 50.93 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 123.834 0.709 . . . . 72.21 112.059 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -74.05 29.96 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.659 0.614 . . . . 73.41 112.659 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.4 t -113.16 179.42 3.97 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.972 -0.751 . . . . 75.32 108.972 177.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.416 HH12 ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -83.27 -29.4 28.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.933 0.397 . . . . 71.34 110.364 -179.733 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -111.19 102.0 51.79 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.098 -0.501 . . . . 74.21 110.43 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.446 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 66.1 Cg_endo -92.03 34.26 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.998 2.465 . . . . 74.13 111.712 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.5 p -149.76 158.07 43.82 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.925 0.393 . . . . 74.43 111.054 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.9 p -148.27 -161.6 1.37 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 72.41 109.667 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 70.2 p-90 -89.76 -5.58 56.82 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.916 0.389 . . . . 72.13 110.584 178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -130.71 0.13 4.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.255 -0.43 . . . . 63.33 111.73 -177.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -148.36 128.72 13.88 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.697 -0.483 . . . . 70.43 109.697 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.7 -31.34 32.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.495 -0.321 . . . . 75.14 111.068 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 20.9 ptmt -140.57 106.93 5.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.391 0.615 . . . . 73.55 111.551 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.6 mm -67.79 102.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.825 -0.805 . . . . 63.05 108.825 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 m -97.68 -11.44 23.5 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.92 -0.582 . . . . 70.24 110.674 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -74.7 129.41 37.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.021 -0.536 . . . . 74.1 110.287 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.477 HG22 ' OE1' ' A' ' 38' ' ' GLU . 9.0 t -87.24 -178.66 6.26 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 120.759 -0.376 . . . . 62.34 110.027 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -62.87 -44.46 96.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.841 -0.163 . . . . 61.32 111.426 -177.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.7 mp0 -57.04 -44.18 82.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.416 -0.356 . . . . 72.12 110.567 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.477 ' OE1' HG22 ' A' ' 35' ' ' THR . 42.1 mt-10 -66.97 -43.87 81.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.847 -0.615 . . . . 55.34 110.727 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.49 -41.21 98.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.015 -0.539 . . . . 74.12 110.584 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.86 -42.1 92.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.903 -0.59 . . . . 75.21 110.05 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 50.3 mm-40 -58.39 -41.57 85.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 73.13 110.474 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.04 -40.73 87.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.856 -0.611 . . . . 52.12 110.036 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.5 mm -53.55 -49.47 55.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.674 -0.694 . . . . 61.11 111.066 179.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -55.23 -47.07 75.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.162 0.506 . . . . 73.33 110.191 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -57.33 -47.29 89.04 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.437 -0.801 . . . . 51.23 112.257 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.3 m-85 -59.94 -52.3 66.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.347 0.118 . . . . 74.1 110.948 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -56.22 -45.95 81.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.023 0.439 . . . . 75.32 110.705 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -66.21 -42.01 89.35 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.887 -0.597 . . . . 75.41 112.142 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 30.0 mtpp -63.58 -37.98 89.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.621 0.248 . . . . 64.15 111.491 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 46' ' ' TYR . 79.0 mt -66.33 -48.16 81.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.39 -0.368 . . . . 55.43 110.718 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -69.98 -18.49 63.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.345 -0.389 . . . . 63.5 111.924 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -91.12 1.05 57.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.912 0.387 . . . . 71.23 110.741 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.08 30.27 69.98 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.999 -0.546 . . . . 75.12 113.363 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -92.11 -53.13 4.38 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.506 -0.408 . . . . 72.32 110.655 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 39.3 mt-10 -137.1 148.02 46.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.08 -0.509 . . . . 74.21 110.077 178.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -81.89 160.82 23.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.093 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -62.81 -53.9 47.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.935 -0.575 . . . . 75.03 110.582 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 2.8 mp0 -58.45 -31.24 67.6 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 65.12 110.509 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 29.7 t -67.23 -52.07 45.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.758 -0.656 . . . . 63.31 109.652 178.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.24 -33.88 76.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.398 -0.365 . . . . 73.41 110.858 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -63.89 -32.44 73.96 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.033 -0.53 . . . . 75.03 111.46 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -95.76 5.72 50.68 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.987 0.423 . . . . 73.51 111.225 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' SER . 27.8 mt-30 -115.43 -53.96 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.193 0.442 . . . . 64.13 112.193 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -108.88 -6.76 15.64 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.661 0.986 . . . . 43.54 113.661 -173.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.445 ' HB2' HD12 ' A' ' 14' ' ' LEU . 11.7 t -78.83 136.92 37.47 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.022 -0.671 . . . . 61.22 110.599 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -95.63 11.61 32.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.847 -0.615 . . . . 75.33 110.367 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 48.3 t -81.81 145.2 30.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.699 -0.682 . . . . 63.44 110.146 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 p -62.4 -26.3 68.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.073 0.463 . . . . 54.02 110.983 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 m -74.94 -4.99 41.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.73 -0.668 . . . . 65.15 111.81 -178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.06 65.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.815 0.34 . . . . 71.43 111.187 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -32.63 74.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.231 0.539 . . . . 74.33 110.624 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.33 16.36 11.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.849 -0.614 . . . . 73.11 110.19 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.493 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 12.3 mpt_? 67.45 14.16 9.54 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.402 -0.817 . . . . 73.35 111.94 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.35 7.65 88.34 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.738 -0.744 . . . . 44.02 112.806 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -80.02 136.95 36.7 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.828 0.347 . . . . 61.23 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 mp -101.49 -21.2 14.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.161 -0.472 . . . . 43.2 110.109 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.96 -171.04 42.3 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.772 -0.931 . . . . 42.01 110.772 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.05 107.93 10.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 117.187 0.494 . . . . 64.24 110.182 179.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.0 p90 -123.59 -174.37 2.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.192 -0.458 . . . . 72.1 110.756 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -148.87 -165.89 2.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.247 -0.649 . . . . 72.01 109.247 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -66.63 134.43 52.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.033 0.444 . . . . 73.53 111.769 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.447 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 102.91 22.91 8.97 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.878 -0.601 . . . . 61.34 112.375 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -122.99 -34.81 3.11 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.33 0.493 . . . . 54.51 112.33 -177.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.1 tpp -135.73 171.33 14.61 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.812 -0.355 . . . . 53.03 111.207 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -55.58 141.61 36.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.315 -0.402 . . . . 72.42 110.273 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.407 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 86.4 tttt -51.96 -48.57 87.76 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.195 0.813 . . . . 71.02 113.195 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 73.3 Cg_exo -51.51 -28.79 29.53 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.209 1.939 . . . . 71.44 113.03 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CD2' HG12 ' A' ' 113' ' ' ILE . 48.1 t80 -95.48 -49.88 5.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.324 0.583 . . . . 74.45 110.387 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 34.7 tt0 -61.21 -50.22 73.96 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.324 -0.853 . . . . 63.01 111.557 -176.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.48 -39.64 95.0 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.899 0.381 . . . . 65.1 111.05 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.61 -32.26 73.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.863 -0.608 . . . . 54.54 111.231 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -60.19 -31.77 70.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.177 -0.465 . . . . 72.31 111.294 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -86.81 -19.49 28.93 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.26 -0.427 . . . . 74.22 110.526 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.93 -42.93 15.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 74.13 111.395 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 69.8 mt -81.79 145.08 30.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.058 -0.519 . . . . 74.25 110.334 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ARG . . . . . 0.517 ' CG ' ' HG2' ' A' ' 99' ' ' GLU . 28.7 ptt180 -80.66 176.9 9.39 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.814 -0.439 . . . . 74.44 109.814 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -66.71 114.43 5.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.131 -0.486 . . . . 62.21 110.821 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.39 6.8 38.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.504 -0.855 . . . . 61.11 113.814 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.517 ' HG2' ' CG ' ' A' ' 96' ' ' ARG . 63.1 mm-40 -88.32 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.387 0.594 . . . . 73.13 111.905 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.9 tpp -104.44 128.47 52.34 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.163 -0.926 . . . . 74.01 109.261 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.43 ' CB ' ' HB ' ' A' ' 113' ' ' ILE . 32.8 t -91.74 156.37 17.61 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 116.454 -0.339 . . . . 75.32 110.223 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.65 -168.2 38.46 Favored Glycine 0 N--CA 1.44 -1.059 0 C-N-CA 120.754 -0.736 . . . . 41.43 111.525 178.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -66.13 102.46 0.56 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.78 2.32 . . . . 75.31 112.35 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.3 110.95 24.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 60.23 109.675 178.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -78.08 110.87 13.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.018 -0.537 . . . . 65.43 111.004 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 m -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.891 -0.781 . . . . 74.13 108.891 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.416 ' HB2' HH12 ' A' ' 22' ' ' ARG . 7.1 p-10 -60.1 -32.63 71.16 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.082 0.401 . . . . 74.31 112.082 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 p -79.36 -35.58 40.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.1 0.476 . . . . 54.22 111.602 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLY . . . . . 0.437 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . 167.97 -162.88 36.68 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 110.863 -0.895 . . . . 72.4 110.863 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.452 HG21 HG13 ' A' ' 43' ' ' ILE . 31.8 mt -87.64 131.75 34.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 109.782 -0.451 . . . . 74.21 109.782 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.62 ' NE2' HD13 ' A' ' 15' ' ' LEU . 14.3 m-70 -121.47 139.65 53.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.282 -0.417 . . . . 74.31 111.163 -178.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.652 HD12 HD23 ' A' ' 14' ' ' LEU . 21.9 mt -109.34 139.5 31.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.15 -1.056 . . . . 74.12 108.15 173.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.507 HG12 ' CD2' ' A' ' 88' ' ' PHE . 23.5 mt -114.68 129.55 70.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 120.744 0.306 . . . . 53.31 111.606 -175.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -133.2 119.58 20.05 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 174.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -84.2 108.26 16.99 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.99 0.424 . . . . 65.22 109.938 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 m -70.18 -51.96 27.09 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.626 -0.715 . . . . 62.12 110.241 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.427 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 75.0 mm-40 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.39 -0.814 . . . . 61.44 109.51 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.885 0.374 . . . . 62.45 110.625 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -109.97 96.12 6.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.453 -0.573 . . . . 73.0 109.453 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.2 p -109.92 145.33 16.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 116.205 -0.452 . . . . 51.31 110.793 -177.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HB3' ' HG3' ' A' ' 117' ' ' GLU . 78.8 ttt180 -109.74 120.44 42.49 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.237 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -134.3 154.47 51.3 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.946 -0.57 . . . . 62.45 110.403 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 m -98.37 149.26 22.83 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.255 -1.017 . . . . 63.53 108.255 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.561 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -148.06 136.96 21.89 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.283 0.564 . . . . 74.21 112.51 -176.677 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.5 tt -106.98 140.77 39.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.271 -0.877 . . . . 70.42 108.817 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -132.91 127.08 33.54 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 110.054 -0.35 . . . . 61.04 110.054 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -122.27 127.83 75.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.018 0.437 . . . . 71.41 110.173 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -91.82 171.8 8.9 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.236 0.541 . . . . 52.41 111.032 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -152.37 163.03 40.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.87 -0.604 . . . . 73.13 109.848 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.8 t -54.64 -41.63 70.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.253 0.549 . . . . 74.35 110.189 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.01 62.31 6.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.873 -0.603 . . . . 74.1 110.113 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.0 t -135.17 165.17 26.01 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.458 -0.571 . . . . 62.41 109.458 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 73.7 mtm180 -63.2 -34.31 77.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.225 0.536 . . . . 73.51 110.116 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -129.98 89.49 45.5 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 115.917 -0.583 . . . . 74.52 110.47 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.43 72.63 5.9 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.657 2.238 . . . . 53.31 111.167 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -157.36 143.4 17.7 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.964 -0.562 . . . . 60.23 109.941 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.4 p -144.84 172.58 12.82 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.684 0.278 . . . . 72.5 110.551 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -88.68 -5.19 58.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.412 0.625 . . . . 75.0 109.434 177.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 43.0 mtp180 -98.63 -48.36 5.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.097 -0.956 . . . . 75.24 111.087 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -114.63 146.93 40.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.152 -0.477 . . . . 73.35 110.56 -175.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -83.58 -47.22 11.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 74.55 110.25 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -121.42 116.96 25.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.381 -0.6 . . . . 51.34 109.381 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.6 mm -75.98 94.02 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.176 -0.465 . . . . 72.24 111.442 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 m -87.54 -25.59 23.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.279 0.562 . . . . 73.32 110.096 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HA ' ' OE2' ' A' ' 38' ' ' GLU . 9.1 ptt180 -60.43 119.47 8.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.362 -0.836 . . . . 73.33 111.834 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -80.72 -178.14 6.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.878 -0.601 . . . . 55.22 110.644 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.16 -35.19 79.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.466 -0.334 . . . . 75.12 110.504 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -64.01 -43.16 96.47 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.3 -0.409 . . . . 62.31 110.976 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 42.4 mt-10 -62.7 -41.37 99.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 74.22 110.653 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.505 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.11 -40.3 97.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.134 -0.484 . . . . 63.22 110.21 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.67 -42.46 91.3 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.7 -0.682 . . . . 63.45 109.974 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -59.54 -42.08 91.5 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.276 -0.42 . . . . 75.23 110.595 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.8 mt -62.04 -45.85 91.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.973 -0.558 . . . . 75.3 110.419 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 39' ' ' ALA . 42.9 mm -55.99 -53.15 41.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.155 -0.475 . . . . 74.04 110.817 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 88.5 m-20 -59.49 -43.7 93.26 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.471 -0.332 . . . . 74.45 110.592 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.42 -49.94 71.64 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.963 -0.562 . . . . 65.13 112.096 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.2 m-85 -61.04 -51.96 66.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.327 0.108 . . . . 75.14 110.784 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.426 HG22 ' HE2' ' A' ' 51' ' ' LYS . 69.7 mt -54.75 -43.29 66.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.829 0.347 . . . . 71.14 111.117 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 14.6 mm100 -63.81 -45.58 88.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.398 -0.365 . . . . 55.14 111.141 178.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -69.01 -36.26 77.6 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 111.842 0.312 . . . . 64.23 111.842 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 46' ' ' TYR . 83.9 mt -61.42 -49.74 83.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.291 . . . . 64.2 110.744 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HE2' HG22 ' A' ' 47' ' ' ILE . 52.0 mtmt -64.66 -34.94 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.22 111.472 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.8 m -65.51 -31.29 72.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.304 -0.407 . . . . 72.0 111.497 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.91 25.65 6.72 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.562 -0.827 . . . . 63.15 111.826 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -89.24 -75.41 0.44 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.118 0.485 . . . . 40.45 110.207 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 8.7 mm-40 -109.67 146.3 35.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.66 -0.7 . . . . 70.31 109.545 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -88.71 159.53 17.76 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 109.643 -0.503 . . . . 74.35 109.643 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -53.59 -42.01 67.17 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.639 0.257 . . . . 71.51 111.126 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.49 -12.74 61.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.386 -0.37 . . . . 74.51 111.559 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -80.01 -29.75 39.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.056 0.455 . . . . 45.13 110.313 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.2 -45.86 7.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.42 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.99 67.27 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.734 0.642 . . . . 72.43 112.734 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.629 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 15.0 m -88.91 -3.25 58.79 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.312 0.486 . . . . 64.54 112.312 -177.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -133.5 -47.32 0.82 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.341 0.497 . . . . 73.24 112.341 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -99.25 23.79 8.76 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.132 0.419 . . . . 71.11 112.132 -174.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -112.47 127.63 56.1 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.083 0.468 . . . . 32.11 110.375 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.492 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 8.2 m-20 -90.24 65.97 6.48 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.023 -0.535 . . . . 73.13 110.252 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.2 p -155.87 169.17 25.04 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.134 -0.485 . . . . 71.35 110.173 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.8 m -69.71 -23.71 63.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.008 0.433 . . . . 74.12 110.588 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.1 m -67.27 -15.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.901 -0.591 . . . . 70.24 111.73 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.34 -30.13 70.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.193 0.52 . . . . 71.22 110.605 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -84.09 -7.95 59.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.925 -0.579 . . . . 72.22 109.974 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.41 21.72 16.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.583 -0.735 . . . . 65.54 110.841 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.629 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 26.9 mtp180 69.45 12.93 8.36 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.996 -0.547 . . . . 74.03 111.699 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.43 -10.31 73.82 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.211 -0.755 . . . . 71.05 111.211 -177.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -71.58 129.33 38.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.815 0.34 . . . . 54.02 110.745 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 76' ' ' LEU . 4.8 tt -89.07 -35.47 16.31 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.166 -0.679 . . . . 74.44 109.166 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.77 -178.02 33.37 Favored Glycine 0 N--CA 1.432 -1.595 0 N-CA-C 110.449 -1.061 . . . . 61.34 110.449 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 112.97 11.87 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.925 0.362 . . . . 62.41 110.132 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -116.03 151.57 35.23 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.814 0.34 . . . . 71.22 111.301 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -169.53 -169.62 0.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.267 -0.642 . . . . 62.54 109.267 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 63.16 18.77 11.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.215 0.606 . . . . 74.44 112.521 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 66.0 33.75 86.43 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.863 -0.684 . . . . 72.51 112.736 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -83.24 -14.26 53.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.894 0.378 . . . . 64.13 111.027 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.5 tpp -115.64 154.27 29.78 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.991 -0.55 . . . . 73.54 109.586 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -51.45 134.49 28.73 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.466 0.479 . . . . 64.31 111.674 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.7 tptt -56.61 -47.78 98.37 Favored Pre-proline 0 CA--C 1.548 0.88 0 N-CA-C 112.809 0.67 . . . . 54.24 112.809 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.1 Cg_endo -54.74 -25.18 41.19 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.257 1.972 . . . . 74.43 111.979 177.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.472 ' CE2' HG12 ' A' ' 113' ' ' ILE . 41.3 t80 -85.84 -43.47 13.26 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.71 -0.677 . . . . 74.31 109.33 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.6 -51.64 68.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.383 -0.826 . . . . 73.45 111.31 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASP . . . . . 0.47 ' OD2' ' HE3' ' A' ' 86' ' ' LYS . 8.8 m-20 -54.5 -46.57 73.49 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.535 -0.302 . . . . 71.4 111.078 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -64.68 -42.24 95.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.806 -0.634 . . . . 74.35 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -65.68 -45.2 83.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.83 0.348 . . . . 71.34 111.269 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -65.73 -24.83 67.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.158 -0.474 . . . . 73.35 111.314 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.76 -5.38 59.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.283 -0.417 . . . . 41.31 111.574 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 96.6 mt -96.69 143.68 27.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.706 0.289 . . . . 72.44 110.389 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -92.17 -179.73 5.33 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.345 -0.389 . . . . 72.42 110.245 176.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.3 m -64.79 125.12 23.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.944 -0.571 . . . . 74.41 110.324 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.29 21.55 64.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.901 -0.666 . . . . 62.33 111.999 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.434 ' HG3' HD22 ' A' ' 95' ' ' LEU . 8.3 tp10 -111.81 143.91 41.98 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.037 0.446 . . . . 72.11 110.917 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -124.79 134.83 52.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.449 -0.796 . . . . 71.43 109.773 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -80.11 -69.0 0.62 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.009 0.433 . . . . 74.11 111.02 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.428 ' O ' ' HA ' ' A' ' 112' ' ' ILE . . . 139.69 -142.82 13.07 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 111.188 -0.765 . . . . 72.11 111.188 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.461 ' HB3' HG21 ' A' ' 43' ' ' ILE . 62.8 Cg_endo -76.45 98.37 1.2 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.552 2.168 . . . . 75.24 112.933 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -95.08 110.95 24.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.237 -0.653 . . . . 64.44 109.237 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -82.51 122.94 28.7 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.126 -0.488 . . . . 75.02 111.834 -177.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.0 p -136.74 174.39 10.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.61 -0.723 . . . . 63.12 109.669 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -62.99 -31.2 72.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.932 0.396 . . . . 73.14 110.961 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.4 p -79.76 -5.65 55.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 71.51 111.793 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 123.1 -156.72 17.52 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.687 -0.768 . . . . 63.3 111.886 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 48.4 mt -97.62 126.97 50.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.588 0.233 . . . . 75.23 110.387 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.549 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 93.1 m-70 -114.34 135.44 54.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.517 -0.311 . . . . 75.34 111.204 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 45.3 mt -105.75 125.37 61.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 107.915 -1.143 . . . . 71.5 107.915 173.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ILE . . . . . 0.472 HG12 ' CE2' ' A' ' 88' ' ' PHE . 32.0 mt -107.71 128.96 62.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.791 0.329 . . . . 65.31 111.779 -176.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.5 tp -131.44 108.88 9.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.771 -0.649 . . . . 71.33 109.589 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -81.43 120.84 25.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.74 0.305 . . . . 75.32 110.68 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 p -100.05 -29.21 12.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.335 -0.393 . . . . 64.3 111.278 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 20.9 mm-40 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.485 -0.769 . . . . 52.41 110.697 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.159 0 N-CA-C 111.749 -0.54 . . . . 22.43 111.749 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.8 m -81.63 107.67 14.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.019 0.438 . . . . 73.51 110.387 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -99.23 6.81 46.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 72.21 111.279 -177.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.2 ptm -150.14 148.02 28.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.467 -0.333 . . . . 73.41 110.92 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -111.28 104.49 56.21 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.938 -0.574 . . . . 65.41 109.745 178.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.432 ' HG3' HH22 ' A' ' 115' ' ' ARG . 87.3 Cg_endo -88.34 137.98 3.81 Favored 'Trans proline' 0 N--CA 1.443 -1.469 0 C-N-CA 122.386 2.057 . . . . 75.2 111.912 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.59 -14.06 35.83 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.287 0.565 . . . . 61.33 109.653 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -127.28 117.17 21.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.345 -0.843 . . . . 73.52 109.788 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.52 137.08 57.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-N 116.327 -0.397 . . . . 72.11 110.378 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 36.6 ttt180 -112.31 125.84 54.62 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.464 -0.334 . . . . 75.52 110.183 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -143.23 139.18 30.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.0 0.429 . . . . 51.01 111.204 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 15.4 m -98.29 153.87 18.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.428 -0.953 . . . . 41.51 108.428 176.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 145.83 37.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.406 0.891 . . . . 71.12 113.406 -175.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.432 ' HG ' ' HB2' ' A' ' 65' ' ' SER . 10.4 tt -122.59 141.01 52.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.945 -1.025 . . . . 73.25 108.322 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.59 HD23 ' CD2' ' A' ' 111' ' ' HIS . 2.7 tm? -139.17 131.05 27.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.93 0.395 . . . . 70.42 110.944 -178.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.414 ' N ' HD22 ' A' ' 15' ' ' LEU . 73.4 t -123.63 126.17 72.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.786 -0.82 . . . . 75.2 108.786 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.449 ' HE2' ' HB3' ' A' ' 26' ' ' SER . 60.8 mttm -71.74 171.48 11.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.063 0.459 . . . . 63.34 111.236 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -142.31 168.72 19.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.805 -0.634 . . . . 64.43 110.117 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.6 m -56.59 -34.63 67.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.896 0.702 . . . . 64.25 112.896 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -89.84 12.64 16.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.416 0.524 . . . . 75.52 112.416 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.5 m -74.59 154.17 38.68 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 110.335 -0.246 . . . . 62.32 110.335 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.15 -42.24 99.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.962 0.411 . . . . 61.14 111.111 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -106.41 104.7 51.61 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 109.51 -0.552 . . . . 74.42 109.51 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.484 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 86.6 Cg_endo -82.93 22.39 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.886 2.391 . . . . 73.32 112.36 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 17' ' ' LYS . 25.8 p -144.44 155.72 43.87 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.699 -0.482 . . . . 72.32 109.699 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.449 ' HB3' ' HE2' ' A' ' 17' ' ' LYS . 88.9 p -136.27 -165.94 1.8 Allowed 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.773 0.32 . . . . 65.43 110.276 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -92.66 8.4 39.3 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.343 0.592 . . . . 64.34 109.868 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -134.35 -32.03 1.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.566 -0.743 . . . . 75.4 111.481 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -116.6 148.19 41.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.855 -0.424 . . . . 52.23 109.855 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -85.15 -39.81 17.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 64.31 110.74 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 25.4 pttm -143.77 134.93 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.925 -0.579 . . . . 75.11 110.527 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mm -88.63 94.08 4.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.176 -0.466 . . . . 61.02 110.143 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 m -82.54 -22.72 34.87 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.717 -0.674 . . . . 70.33 110.653 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -73.05 134.77 44.71 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.172 -0.467 . . . . 61.31 111.003 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.9 t -92.5 -171.16 2.69 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.311 -0.404 . . . . 54.21 110.23 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -52.15 -53.87 37.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.164 0.585 . . . . 62.13 111.783 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 13.7 mm-40 -64.39 -39.99 94.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.174 -0.466 . . . . 73.33 112.221 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.82 -37.9 87.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.897 0.379 . . . . 71.55 110.91 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -72.59 -35.79 67.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.107 0.48 . . . . 52.33 109.975 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 40.1 tp -62.55 -37.5 86.38 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.531 -0.759 . . . . 64.41 111.059 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 48.4 mt-10 -60.99 -42.42 98.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.447 -0.342 . . . . 72.22 110.106 178.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.3 -45.71 90.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.029 -0.532 . . . . 74.11 109.984 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.1 mm -54.45 -53.2 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.766 -0.652 . . . . 75.34 110.645 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -62.04 -35.33 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.049 -0.523 . . . . 73.44 110.99 179.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -61.33 -48.98 82.33 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.565 -0.614 . . . . 71.3 111.565 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.447 ' CD1' HD12 ' A' ' 60' ' ' LEU . 15.8 m-85 -56.61 -51.42 68.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.869 0.366 . . . . 72.14 110.113 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 78.3 mt -55.89 -48.8 77.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 115.515 -0.766 . . . . 65.31 111.316 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.78 -42.11 92.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.286 -0.416 . . . . 73.42 111.493 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 45.1 mtpt -62.97 -42.26 99.78 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.794 0.33 . . . . 73.44 111.113 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 78.9 mt -64.98 -47.94 86.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.141 -0.481 . . . . 73.02 111.024 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -64.17 -32.93 74.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.722 0.296 . . . . 74.11 111.566 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.8 m -76.23 -28.37 57.15 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.801 0.334 . . . . 74.2 111.312 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.35 13.37 28.71 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.397 -0.906 . . . . 74.32 111.933 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.64 -46.49 63.19 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.531 -0.544 . . . . 64.52 109.531 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 36.7 mt-10 -145.28 177.38 8.85 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.576 -0.738 . . . . 74.51 109.807 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -118.55 157.31 27.57 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.01 -0.737 . . . . 72.33 109.01 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -55.16 -24.74 28.13 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.331 0.493 . . . . 43.42 112.331 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -55.21 -51.0 67.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.922 0.341 . . . . 73.42 111.922 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.0 p -70.51 -39.71 73.93 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 120.906 0.384 . . . . 61.31 110.992 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.447 HD12 ' CD1' ' A' ' 46' ' ' TYR . 3.6 mm? -64.15 -46.94 81.83 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.982 -0.553 . . . . 73.22 111.336 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.504 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -72.95 -10.37 59.73 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.256 0.465 . . . . 74.43 112.256 -178.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.619 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 40.5 m -101.49 -52.25 3.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 64.33 111.793 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -102.62 -2.57 28.12 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.01 0.744 . . . . 70.14 113.01 -174.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -128.69 16.68 6.39 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 120.827 0.346 . . . . 73.41 111.05 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.432 ' HB2' ' HG ' ' A' ' 14' ' ' LEU . 23.3 t -125.27 149.89 47.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 73.4 111.063 -178.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -92.0 -14.96 28.59 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.581 -0.736 . . . . 74.32 110.306 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.1 m -55.3 134.1 49.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.751 -0.659 . . . . 74.42 111.241 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.6 m -60.02 -25.83 65.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 73.11 110.808 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 m -68.64 -6.8 28.0 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.077 -0.511 . . . . 70.23 111.602 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.73 -29.1 58.93 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.669 0.387 . . . . 42.2 111.704 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -71.43 -17.32 62.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.05 0.453 . . . . 74.51 110.898 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 73' ' ' ARG . . . -114.16 30.03 7.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.84 -0.618 . . . . 52.21 109.922 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.619 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 86.8 mtm180 74.37 10.87 4.2 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.549 -0.751 . . . . 75.05 112.406 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.504 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 86.17 2.51 85.68 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.843 -0.694 . . . . 62.45 113.126 177.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.474 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 30.4 t70 -85.23 140.72 30.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.903 0.382 . . . . 74.51 111.247 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.5 mt -94.01 -12.2 29.16 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 71.42 110.645 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 81.09 -166.32 48.22 Favored Glycine 0 N--CA 1.436 -1.351 0 N-CA-C 111.169 -0.773 . . . . 52.31 111.169 -177.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.84 109.11 17.86 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.935 0.398 . . . . 72.13 110.412 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.9 p90 -115.93 176.45 5.08 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 116.211 -0.449 . . . . 74.21 110.21 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.5 t -121.54 -172.13 2.36 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 110.05 -0.352 . . . . 74.54 110.05 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -73.8 149.33 41.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.205 -0.452 . . . . 62.41 110.255 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.96 36.19 57.46 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.792 -0.718 . . . . 23.51 111.745 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -126.8 -22.91 3.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.663 0.268 . . . . 64.12 111.534 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.434 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 46.8 tpp -131.63 164.54 25.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.736 -0.211 . . . . 74.44 110.902 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -52.32 139.63 23.83 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.585 -0.279 . . . . 42.4 110.44 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 55.8 tptt -51.57 -51.45 69.46 Favored Pre-proline 0 CA--C 1.551 1.004 0 N-CA-C 113.408 0.892 . . . . 73.41 113.408 -176.142 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.7 Cg_exo -56.32 -28.62 72.97 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.073 1.848 . . . . 63.12 112.741 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.588 ' CE2' HG12 ' A' ' 113' ' ' ILE . 21.4 t80 -90.25 -52.33 4.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.161 -0.472 . . . . 75.33 110.346 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.27 -49.84 76.02 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.736 -0.665 . . . . 72.52 111.439 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.75 -32.7 74.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 73.31 110.725 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.34 -37.16 71.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.042 -0.526 . . . . 62.21 110.142 178.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.458 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 40.3 m -59.01 -45.19 91.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.276 -0.42 . . . . 73.22 110.595 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -69.82 -28.31 65.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.394 -0.366 . . . . 65.41 111.026 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.81 -30.91 59.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 62.45 111.073 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 89.8 mt -72.2 168.03 19.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.19 -0.459 . . . . 71.34 110.466 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -104.06 173.52 6.27 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.313 -0.403 . . . . 73.32 109.972 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.1 m -69.51 116.21 9.66 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.879 -0.415 . . . . 51.34 109.879 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.51 45.96 5.36 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.888 -0.885 . . . . 51.15 110.888 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.41 130.86 52.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.698 0.285 . . . . 65.25 110.768 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.2 ttp -109.3 108.28 18.81 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.114 -0.494 . . . . 71.34 109.754 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.451 ' HB2' HD11 ' A' ' 95' ' ' LEU . 47.7 t -73.25 155.9 39.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.777 -0.647 . . . . 62.03 110.653 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.42 -154.64 15.03 Favored Glycine 0 N--CA 1.435 -1.41 0 CA-C-N 115.775 -0.648 . . . . 53.24 112.231 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.79 104.57 0.69 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.054 2.503 . . . . 71.44 113.053 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.9 t -101.78 117.65 47.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 51.2 109.688 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.13 124.14 28.99 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.902 0.382 . . . . 72.23 110.996 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -135.0 -173.72 3.39 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 116.193 -0.458 . . . . 72.14 109.927 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 106' ' ' THR . 4.6 m-20 -49.61 -61.9 1.85 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.713 0.805 . . . . 72.45 112.699 -177.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.5 p -64.8 -37.23 86.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.459 0.54 . . . . 74.5 112.459 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 163.06 -139.19 5.75 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.635 -0.793 . . . . 72.3 112.009 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.5 mt -91.21 129.18 42.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 120.776 0.322 . . . . 71.04 110.145 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.59 ' CD2' HD23 ' A' ' 15' ' ' LEU . 10.7 m170 -116.69 143.81 45.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.106 -0.497 . . . . 72.35 110.996 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 52.2 mt -110.73 126.16 68.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 108.138 -1.06 . . . . 75.21 108.138 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.588 HG12 ' CE2' ' A' ' 88' ' ' PHE . 20.2 mt -108.18 116.44 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.65 0.262 . . . . 71.44 111.295 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.7 tp -113.5 101.65 9.55 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 110.018 -0.364 . . . . 74.32 110.018 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 92' ' ' SER . 75.0 ttt180 -84.7 106.78 16.51 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.669 -0.412 . . . . 75.23 109.976 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.1 p -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.065 -0.516 . . . . 74.34 110.719 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.359 -0.829 . . . . 64.23 110.322 179.851 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.292 0 N-CA-C 111.83 -0.508 . . . . 60.35 111.83 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -72.14 128.83 36.89 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.711 0.291 . . . . 64.41 110.282 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -124.04 127.27 47.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.916 0.388 . . . . 74.21 112.018 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 87.2 mtp -88.51 71.88 8.88 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.34 -0.985 . . . . 75.43 108.34 175.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.82 138.35 31.84 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.25 -0.886 . . . . 75.4 109.837 -176.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.403 ' HB3' HH22 ' A' ' 115' ' ' ARG . 52.6 Cg_exo -54.8 105.32 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.604 2.203 . . . . 51.51 112.212 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.03 -46.94 8.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.158 -0.474 . . . . 72.13 110.295 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HG2' ' HB1' ' A' ' 78' ' ' ALA . 74.9 ttt180 -111.75 111.32 22.21 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.562 -0.903 . . . . 74.44 108.562 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.93 160.74 8.77 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-O 121.133 0.492 . . . . 62.2 111.796 -174.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.556 ' HB3' ' CG ' ' A' ' 117' ' ' GLU . 67.0 ttt180 -133.27 122.57 24.1 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 109.236 -0.653 . . . . 74.52 109.236 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -134.78 145.41 48.37 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.074 0.464 . . . . 72.34 111.336 -177.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -99.89 140.95 33.36 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.231 -1.026 . . . . 73.51 108.231 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.526 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 9.4 p80 -125.4 133.33 52.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.935 0.717 . . . . 74.41 112.935 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.477 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 6.5 tt -112.84 124.04 51.68 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.349 -1.352 . . . . 54.43 107.349 174.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HB3' ' HB2' ' A' ' 67' ' ' SER . 39.9 tp -108.89 127.77 54.33 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 112.23 0.455 . . . . 51.43 112.23 -177.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.3 p -118.03 114.0 43.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.354 -0.839 . . . . 52.35 108.943 174.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -85.16 175.62 8.86 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.031 -0.531 . . . . 63.4 111.166 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -145.15 165.59 27.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.108 -0.496 . . . . 73.13 110.701 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 32' ' ' ILE . 33.3 t -54.93 -52.21 63.68 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.682 0.614 . . . . 71.32 112.281 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -84.03 38.22 0.64 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.211 0.449 . . . . 52.41 112.211 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.4 t -91.54 162.63 14.45 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.973 -0.38 . . . . 73.41 109.973 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -12.52 60.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.228 0.537 . . . . 74.42 110.446 177.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -149.69 83.1 6.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.499 -0.773 . . . . 72.44 109.056 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -81.46 25.57 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.389 2.726 . . . . 53.14 112.576 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.0 p -122.9 138.9 54.53 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.522 -0.308 . . . . 65.02 110.67 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -136.11 -167.08 1.98 Allowed 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.421 -0.354 . . . . 75.32 110.285 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 68.6 p-90 -83.75 -19.51 35.01 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.257 -0.428 . . . . 74.23 110.429 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -102.73 -43.55 5.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.984 -0.553 . . . . 50.41 110.97 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -124.07 115.52 21.3 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.3 -0.63 . . . . 72.21 109.3 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -67.93 -31.2 70.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.393 -0.367 . . . . 74.04 110.605 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 20.6 ptmt -134.86 105.99 6.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.268 0.556 . . . . 75.21 111.02 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 19' ' ' SER . 28.4 mm -71.73 122.32 23.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.662 -0.699 . . . . 72.1 109.281 177.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.6 p -104.75 -17.85 14.47 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.653 0.263 . . . . 73.31 111.426 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -65.36 141.8 58.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.845 0.355 . . . . 73.21 110.327 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.9 t -97.59 -179.15 4.37 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.448 -0.342 . . . . 64.11 110.995 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -56.65 -47.64 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.911 -0.586 . . . . 62.32 111.464 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 10.8 mm-40 -59.18 -45.47 90.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.029 -0.532 . . . . 64.43 111.097 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.65 -38.84 92.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 54.21 110.505 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.12 -40.8 90.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 71.54 110.722 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.39 -38.98 89.01 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.244 -0.435 . . . . 71.33 110.433 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 49.2 mt-10 -63.54 -35.47 80.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 74.43 110.252 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.8 mt -70.02 -41.36 74.41 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.752 -0.658 . . . . 74.42 109.946 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.5 mm -53.51 -55.79 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.963 -0.562 . . . . 54.23 110.15 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.592 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.6 m-20 -57.26 -40.06 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.623 -0.717 . . . . 73.21 110.716 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.46 -46.83 93.28 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.98 -0.555 . . . . 71.11 112.181 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -60.62 -44.73 96.0 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.062 0.458 . . . . 74.14 109.909 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 43' ' ' ILE . 70.1 mt -56.88 -45.94 83.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-N 115.529 -0.76 . . . . 71.34 111.075 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 66.1 mm-40 -60.6 -44.76 95.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 72.31 110.979 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.471 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 66.4 mttm -62.18 -40.96 97.79 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.066 -0.516 . . . . 54.23 111.63 -177.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.5 mt -72.27 -47.82 51.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.184 -0.462 . . . . 63.04 111.475 -178.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.49 -26.6 65.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.526 0.565 . . . . 73.25 112.526 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -85.07 -1.19 56.56 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.879 0.371 . . . . 72.12 111.274 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.44 75.43 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.788 -0.72 . . . . 31.15 112.417 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -84.54 -54.98 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.449 -0.575 . . . . 73.33 109.449 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.471 ' OE2' ' HD3' ' A' ' 49' ' ' LYS . 43.3 mt-10 -133.37 176.48 8.49 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.23 -0.895 . . . . 74.24 109.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.494 ' O ' HD13 ' A' ' 60' ' ' LEU . 3.1 p30 -122.77 165.26 16.87 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.244 0.545 . . . . 75.11 111.683 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.5 t80 -61.84 -43.72 98.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.176 -0.92 . . . . 75.52 111.82 -176.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 73' ' ' ARG . 45.6 mt-10 -64.29 -42.83 96.22 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.282 0.475 . . . . 72.21 112.282 -176.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.9 t -66.58 -34.93 79.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.136 0.494 . . . . 72.14 110.191 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' ASP . 10.5 mp -77.84 -29.69 50.63 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.894 -0.594 . . . . 73.32 111.11 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.96 -49.2 77.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.774 0.321 . . . . 74.45 111.281 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.545 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 26.4 m -75.13 12.04 1.0 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.431 0.53 . . . . 45.51 112.431 -178.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -133.77 -57.51 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.398 . . . . 74.32 111.731 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -93.61 21.27 6.49 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.925 -0.579 . . . . 73.03 112.439 -174.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.3 t -118.09 142.43 47.42 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.347 -0.541 . . . . 54.41 110.468 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -97.54 12.57 32.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.891 -0.595 . . . . 74.03 110.473 -178.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 36.1 t -98.38 144.4 27.8 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.211 -0.449 . . . . 51.41 110.807 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.1 m -71.14 -16.25 62.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 74.25 110.177 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -73.33 -6.78 48.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.019 -0.537 . . . . 70.45 110.693 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.545 ' HB1' ' HA ' ' A' ' 62' ' ' SER . . . -67.09 -25.17 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.961 -0.563 . . . . 60.32 109.897 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -64.57 -35.04 79.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.343 -0.844 . . . . 75.22 109.488 177.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.0 19.08 3.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.538 -0.756 . . . . 70.23 110.894 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 58' ' ' GLU . 18.9 mtp180 69.61 8.07 6.55 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.273 0.629 . . . . 72.35 111.785 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.19 -9.75 68.72 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.929 -0.653 . . . . 61.34 113.085 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.1 123.93 30.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.017 0.436 . . . . 62.14 111.535 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.3 mt -90.54 -25.38 20.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.677 -0.692 . . . . 73.23 111.028 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.52 -169.54 16.34 Favored Glycine 0 N--CA 1.434 -1.463 0 N-CA-C 111.072 -0.811 . . . . 45.14 111.072 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 8' ' ' ARG . . . -86.57 109.91 19.45 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.077 0.465 . . . . 74.43 111.197 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -118.25 177.13 4.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.922 -0.581 . . . . 72.32 110.118 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.4 t -141.41 176.49 8.82 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.864 -0.421 . . . . 64.45 109.864 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.618 ' O ' ' HD2' ' A' ' 81' ' ' ARG . 6.9 ppt_? -60.42 128.79 38.42 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.37 0.605 . . . . 72.31 111.733 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 111.82 12.0 15.43 Favored Glycine 0 N--CA 1.437 -1.278 0 CA-C-N 115.317 -0.856 . . . . 72.15 111.354 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.97 -33.33 3.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.885 0.374 . . . . 74.43 110.907 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.464 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 44.1 tpp -112.62 165.31 12.38 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.827 0.346 . . . . 61.02 111.447 -176.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -74.57 148.49 40.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 61.23 110.052 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.2 tptt -40.69 -55.45 4.49 Favored Pre-proline 0 N--CA 1.484 1.248 0 N-CA-C 114.559 1.318 . . . . 74.35 114.559 -175.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 14.8 Cg_endo -55.77 -29.02 69.86 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.731 2.287 . . . . 50.44 113.787 -176.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.503 ' CE2' HG12 ' A' ' 113' ' ' ILE . 10.3 t80 -100.53 -39.76 7.76 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.062 0.458 . . . . 62.4 110.092 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.86 -64.28 0.96 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 75.32 111.414 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.35 -35.41 77.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.847 -0.615 . . . . 73.23 111.391 -176.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -65.41 -33.34 75.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 73.45 111.237 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 71.9 m -64.4 -28.48 69.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.012 0.434 . . . . 74.1 111.536 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.86 -7.27 57.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 75.14 110.569 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.72 -3.59 23.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.979 -0.555 . . . . 74.51 111.466 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.5 mt -99.96 135.97 40.58 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 74.32 111.137 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -98.15 166.53 11.37 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.787 -0.642 . . . . 74.41 110.382 178.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -57.28 123.25 14.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.878 0.371 . . . . 72.21 111.487 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.5 -6.99 77.96 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.76 -0.733 . . . . 72.11 112.28 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -93.24 143.92 25.8 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.989 -0.374 . . . . 73.1 109.989 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.7 ttp -135.08 136.16 41.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.202 -0.454 . . . . 73.25 110.935 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -99.6 123.0 43.45 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.962 -0.755 . . . . 71.42 108.962 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.35 -76.31 1.31 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.698 -0.763 . . . . 60.31 113.937 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.68 83.9 1.29 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.716 2.277 . . . . 74.24 113.862 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 111' ' ' HIS . 90.1 t -116.6 102.85 14.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.155 -0.683 . . . . 53.44 109.155 175.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -83.59 122.69 28.92 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.131 0.491 . . . . 72.55 111.667 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.542 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -131.61 -168.49 2.03 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.857 -0.794 . . . . 73.43 108.857 178.338 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.542 ' H ' HG22 ' A' ' 106' ' ' THR . 5.5 m-20 -55.0 -56.08 23.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.449 0.537 . . . . 62.23 112.449 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.3 p -71.44 -30.63 66.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.775 0.657 . . . . 71.45 112.775 -177.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -138.33 6.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.311 -0.947 . . . . 62.43 111.892 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 49.3 mt -91.7 127.67 43.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 120.929 0.395 . . . . 71.21 110.528 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.518 ' O ' ' HB ' ' A' ' 104' ' ' VAL . 13.5 m-70 -110.56 128.96 55.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.894 -0.593 . . . . 73.41 109.886 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.6 mt -99.38 123.51 52.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.895 -0.779 . . . . 72.43 108.895 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.503 HG12 ' CE2' ' A' ' 88' ' ' PHE . 14.8 mt -107.37 113.9 44.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.138 -0.483 . . . . 73.25 110.982 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 54.0 tp -104.55 123.81 48.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.554 -0.294 . . . . 74.44 110.54 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.403 HH22 ' HB3' ' A' ' 6' ' ' PRO . 8.5 tpt180 -87.58 99.16 11.84 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.833 -0.432 . . . . 70.21 109.833 177.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.5 p -80.87 -46.09 15.81 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.968 -0.56 . . . . 51.53 111.699 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.556 ' CG ' ' HB3' ' A' ' 10' ' ' ARG . 70.8 mm-40 . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.695 -0.669 . . . . 75.44 111.045 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.214 0 N-CA-C 111.823 -0.511 . . . . 60.01 111.823 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -66.64 -33.13 74.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 41.25 110.629 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -96.71 130.66 43.9 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.922 -0.581 . . . . 72.12 109.7 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 61.3 mtt -75.42 128.53 35.56 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.514 -0.55 . . . . 73.21 109.514 177.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 73.0 153.45 0.15 Allowed Pre-proline 0 C--O 1.238 0.464 0 O-C-N 124.021 0.826 . . . . 50.41 110.152 -178.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD2' ' O ' ' A' ' 93' ' ' PHE . 45.4 Cg_exo -57.96 129.27 32.4 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 122.257 1.971 . . . . 75.53 111.404 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.85 -57.86 5.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.497 -0.319 . . . . 71.55 110.479 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -106.98 142.14 37.07 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.657 -0.497 . . . . 73.11 109.657 177.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.552 HG12 ' NH1' ' A' ' 115' ' ' ARG . 25.9 m -139.38 129.46 31.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 120.878 0.37 . . . . 71.44 111.384 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 0.7 OUTLIER -100.24 107.38 19.2 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 107.806 -1.183 . . . . 75.04 107.806 171.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.3 m -133.32 144.7 49.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.806 -0.634 . . . . 74.51 111.367 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -103.52 155.8 18.25 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.536 -0.913 . . . . 73.15 108.536 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.507 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.2 p80 -137.68 141.57 41.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.861 0.689 . . . . 74.21 112.861 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 15' ' ' LEU . 7.4 tt -115.44 143.23 45.6 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.796 -1.187 . . . . 74.24 107.796 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.531 HD13 ' CE1' ' A' ' 111' ' ' HIS . 40.7 tp -126.8 124.65 40.16 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.998 0.427 . . . . 74.25 111.9 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.1 t -112.81 118.39 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 115.445 -0.798 . . . . 74.34 109.056 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -86.5 -173.99 4.79 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.5 0.667 . . . . 74.42 111.284 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -160.65 172.96 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.062 -0.972 . . . . 72.33 108.498 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.7 m -54.05 -42.52 69.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.922 0.342 . . . . 64.2 111.922 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -88.43 54.95 3.22 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 75.21 111.597 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 t -108.03 170.07 8.23 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.827 -0.434 . . . . 73.31 109.827 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.517 ' NE ' ' HA ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -73.28 -30.3 63.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.358 0.599 . . . . 71.11 109.923 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -134.81 94.81 16.17 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.555 -0.748 . . . . 75.11 109.45 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 85.6 Cg_endo -80.01 33.69 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 74.43 112.263 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -143.66 126.57 16.27 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.937 -0.574 . . . . 52.21 109.741 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.3 m -135.6 175.64 9.41 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.398 -0.364 . . . . 72.02 110.627 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -73.28 -14.0 61.23 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.191 -0.459 . . . . 75.32 111.203 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -91.15 -44.24 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 71.02 110.548 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -136.31 134.45 37.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.928 -0.578 . . . . 65.21 110.192 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.43 -47.84 83.94 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.091 -0.504 . . . . 74.12 111.069 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 60.7 pttt -126.66 113.43 16.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.051 0.453 . . . . 70.4 110.485 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.45 104.14 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.703 -0.681 . . . . 74.21 110.199 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.5 m -114.63 96.44 5.75 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 116.017 -0.538 . . . . 73.21 110.221 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -167.47 134.35 2.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.822 -0.626 . . . . 65.4 110.09 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 t -74.99 174.74 8.9 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.223 -0.444 . . . . 73.33 110.735 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -58.05 -38.18 75.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.824 0.345 . . . . 74.54 110.577 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.7 mt-10 -58.02 -46.39 85.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.784 -0.644 . . . . 74.11 110.772 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 74.5 mm-40 -59.96 -43.46 95.04 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.14 111.104 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -64.25 -42.12 96.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.02 -0.536 . . . . 74.32 110.254 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.7 tp -63.73 -43.76 95.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.671 -0.695 . . . . 63.14 110.667 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 64.6 mm-40 -59.95 -43.03 95.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.08 -0.509 . . . . 73.52 110.754 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 83.9 mt -63.89 -48.71 75.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.331 -0.395 . . . . 75.04 110.664 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 39' ' ' ALA . 30.6 mm -55.49 -56.98 9.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.076 -0.511 . . . . 63.03 111.053 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 39.7 m-80 -60.07 -35.95 76.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.266 -0.425 . . . . 71.24 110.892 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.31 -49.48 75.73 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.768 -0.651 . . . . 24.42 111.979 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.423 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 26.6 m-85 -61.24 -47.1 87.62 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.978 -0.378 . . . . 74.32 109.978 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.7 mt -51.12 -51.48 21.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.73 -0.668 . . . . 63.32 111.21 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 68.4 mm-40 -63.18 -40.11 96.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.485 -0.325 . . . . 73.33 111.149 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -62.39 -47.14 85.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.945 0.402 . . . . 63.43 110.957 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.77 -46.02 83.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.914 -0.584 . . . . 75.12 111.369 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -64.45 -38.55 91.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.431 -0.349 . . . . 51.21 111.527 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.1 t -70.62 -20.86 62.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.9 0.381 . . . . 64.31 110.836 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 94.3 18.4 36.41 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.68 -0.771 . . . . 63.32 112.452 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.2 -66.46 0.54 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.184 0.516 . . . . 71.13 111.053 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -137.38 161.88 35.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.518 -0.765 . . . . 73.44 110.692 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -78.7 144.87 34.9 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.048 -0.524 . . . . 71.45 112.089 -177.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.04 -41.73 94.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.662 -0.699 . . . . 74.52 110.055 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -59.83 -33.26 71.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.813 -0.631 . . . . 75.42 110.755 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.9 t -77.89 -34.52 51.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.985 -0.552 . . . . 72.21 110.619 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 99.1 mt -76.71 -40.85 47.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.475 -0.33 . . . . 75.44 111.157 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.58 -16.44 63.86 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.252 0.464 . . . . 75.34 112.252 -177.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.5 p -95.08 -4.65 45.95 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.739 0.304 . . . . 65.13 111.447 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -126.01 -58.68 1.37 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 120.872 0.368 . . . . 70.34 111.909 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.423 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 88.5 m-85 -93.94 38.4 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.257 -0.429 . . . . 71.31 112.058 -174.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -121.63 128.62 52.11 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.198 -0.668 . . . . 65.34 109.198 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -69.37 -28.72 66.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.089 0.471 . . . . 74.25 110.755 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 p -61.83 143.98 55.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 51.13 111.295 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.2 m -74.56 -8.55 56.7 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.195 0.522 . . . . 73.42 110.742 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.7 m -70.46 -4.47 22.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 54.32 111.058 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.53 -32.57 51.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.018 -0.537 . . . . 72.41 111.889 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -66.24 -33.28 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 72.53 110.74 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.62 7.48 36.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.64 -0.504 . . . . 61.43 109.64 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? 64.92 18.37 11.46 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.342 -0.844 . . . . 74.4 110.87 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 67.76 19.88 71.75 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.719 -0.673 . . . . 50.32 112.577 -179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.74 139.05 31.06 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.872 0.336 . . . . 63.22 111.14 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.0 mt -115.21 2.38 14.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.171 -0.468 . . . . 73.24 110.766 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.573 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 71.63 -154.94 51.84 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.36 -0.924 . . . . 72.33 111.062 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -91.87 108.39 19.89 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.859 0.362 . . . . 70.23 110.299 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.42 171.93 7.53 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.156 -0.474 . . . . 63.23 110.675 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.2 t -160.7 171.66 18.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.826 0.346 . . . . 71.45 111.43 -177.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 64.48 -82.38 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.31 1.044 . . . . 73.34 112.91 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -174.43 86.68 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.581 -0.819 . . . . 21.35 112.134 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -102.07 -24.07 14.0 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.483 -0.562 . . . . 54.4 109.483 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' MET . . . . . 0.424 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 35.8 tpp -113.86 172.12 7.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.54 -0.754 . . . . 71.25 109.517 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.96 141.56 33.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.45 0.167 . . . . 72.25 111.221 178.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.447 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.5 tptm -50.32 -50.5 70.46 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 113.645 0.98 . . . . 64.53 113.645 -176.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.447 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 77.0 Cg_exo -52.52 -35.32 66.18 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 121.993 1.796 . . . . 71.32 112.262 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 38.1 t80 -82.11 -50.14 9.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.746 -0.661 . . . . 73.01 110.308 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' HG2' ' HA2' ' A' ' 82' ' ' GLY . 2.5 tp10 -61.25 -30.04 70.21 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.857 -0.61 . . . . 71.1 111.036 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.6 -29.68 70.2 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.756 -0.657 . . . . 75.15 110.376 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.57 -24.48 21.71 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.771 -0.65 . . . . 61.34 110.922 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 m -58.82 -41.18 86.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.987 0.422 . . . . 64.44 111.077 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.412 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 55.0 m-85 -91.24 12.84 18.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 65.02 111.179 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.47 -26.56 26.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.726 0.298 . . . . 72.23 111.26 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.428 ' H ' HD22 ' A' ' 95' ' ' LEU . 1.4 mm? -79.35 127.77 32.5 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.255 -0.429 . . . . 75.15 110.497 -178.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -86.01 -67.21 0.83 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.267 -0.424 . . . . 75.44 111.145 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 65.3 m -138.67 108.06 6.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.61 -0.268 . . . . 73.12 111.34 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.562 ' HA2' ' O ' ' A' ' 115' ' ' ARG . . . 51.56 44.5 53.87 Favored Glycine 0 C--N 1.332 0.337 0 CA-C-N 115.926 -0.579 . . . . 72.55 113.163 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -106.77 161.48 14.63 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 122.692 -0.299 . . . . 70.11 110.745 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.4 ttp -124.7 135.6 53.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.201 -0.454 . . . . 54.5 110.239 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.8 t -89.79 151.39 21.82 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.613 -0.514 . . . . 74.33 109.613 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.54 -144.92 4.59 Favored Glycine 0 N--CA 1.44 -1.04 0 C-N-CA 121.011 -0.614 . . . . 34.43 112.756 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.87 103.36 1.0 Allowed 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.67 2.247 . . . . 73.3 113.184 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -92.89 109.58 21.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.054 -0.521 . . . . 71.45 109.669 177.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -82.28 127.89 33.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.283 -0.417 . . . . 75.23 111.457 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 38.8 p -138.08 -166.16 1.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.806 -0.634 . . . . 61.54 110.165 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -70.43 -47.3 61.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.791 0.329 . . . . 72.1 111.33 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -69.45 -37.77 77.5 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.227 -0.442 . . . . 31.33 111.377 -177.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.93 -138.95 5.68 Favored Glycine 0 N--CA 1.441 -0.993 0 C-N-CA 120.766 -0.73 . . . . 70.04 111.696 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.5 mt -108.4 135.9 45.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 110.107 -0.331 . . . . 71.34 110.107 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.531 ' CE1' HD13 ' A' ' 15' ' ' LEU . 39.7 m-70 -120.4 152.59 37.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.717 0.294 . . . . 74.23 110.784 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 62.9 mt -115.46 128.3 72.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.004 -1.11 . . . . 72.01 108.004 173.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.8 mt -116.24 123.08 71.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.542 0.21 . . . . 72.01 111.112 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.0 tp -120.45 120.96 37.43 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.619 -0.264 . . . . 61.41 111.07 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.562 ' O ' ' HA2' ' A' ' 98' ' ' GLY . 18.8 ttt180 -89.08 119.36 29.52 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.576 -0.898 . . . . 71.53 108.576 175.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 m -85.82 -12.9 49.67 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 120.852 0.358 . . . . 75.31 111.344 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 39.2 mt-10 . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.58 -0.724 . . . . 74.24 110.858 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.236 0 N-CA-C 111.778 -0.529 . . . . 73.34 111.778 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -148.11 155.56 41.58 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 116.903 0.352 . . . . 72.55 110.509 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -81.98 -23.68 35.91 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.377 -0.601 . . . . 62.33 109.377 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -85.03 95.68 9.17 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.489 -0.778 . . . . 74.22 109.227 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -74.71 131.48 79.51 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.76 -0.655 . . . . 75.31 110.768 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.87 163.53 38.12 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 123.138 2.559 . . . . 63.02 113.022 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -94.22 -12.39 28.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.12 -0.491 . . . . 72.22 111.228 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -117.59 121.95 42.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.302 -0.408 . . . . 65.5 110.559 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.5 m -136.23 150.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 116.247 -0.433 . . . . 64.04 110.714 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 74.3 ttt180 -110.44 114.71 28.35 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.914 -0.773 . . . . 62.54 108.914 176.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m -129.01 152.55 48.5 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.25 0.548 . . . . 72.3 111.677 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -104.71 149.93 25.17 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.245 -1.02 . . . . 75.33 108.245 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -139.81 149.29 43.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.706 0.632 . . . . 71.13 112.706 -176.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HA ' ' OG ' ' A' ' 65' ' ' SER . 8.8 tt -118.49 131.43 56.25 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.361 -0.977 . . . . 73.15 108.361 175.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.627 ' O ' ' HA ' ' A' ' 65' ' ' SER . 2.6 tm? -123.69 112.12 17.0 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.847 0.356 . . . . 71.22 110.535 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.409 HG11 HD11 ' A' ' 43' ' ' ILE . 9.3 p -109.99 122.23 64.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.429 0.633 . . . . 70.55 110.605 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -85.03 177.46 7.92 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.597 -0.729 . . . . 75.23 110.922 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.32 173.85 15.07 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.015 -0.539 . . . . 71.45 110.371 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.1 p -56.64 -53.59 55.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.258 0.466 . . . . 74.5 112.258 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -89.83 47.16 1.43 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.12 0.486 . . . . 73.5 110.696 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.2 t -92.3 173.91 7.57 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.977 -0.556 . . . . 42.53 110.419 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.46 ' HD2' ' OD1' ' A' ' 107' ' ' ASP . 46.6 ttt180 -68.89 -22.38 64.19 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.494 -0.928 . . . . 70.33 108.494 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.2 tpp180 -150.46 98.61 3.24 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 114.562 -1.199 . . . . 71.42 108.746 176.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.412 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 71.8 Cg_endo -76.14 26.07 0.42 Allowed 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.214 2.609 . . . . 73.11 112.971 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.9 m -130.92 147.39 52.56 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.986 -0.552 . . . . 72.31 109.565 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.4 p -134.31 -178.42 5.04 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.88 0.371 . . . . 72.41 110.337 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 66' ' ' ASP . 44.4 p-90 -81.53 -0.78 43.57 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.587 -0.523 . . . . 75.32 109.587 175.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -102.36 -52.55 3.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.565 -0.743 . . . . 73.25 110.261 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -132.65 165.23 24.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.34 111.462 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.69 -38.91 28.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.034 -0.53 . . . . 53.12 111.184 -177.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 17.9 ptmt -135.67 125.58 25.79 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 120.936 0.398 . . . . 54.31 111.172 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.15 122.07 34.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.992 -0.549 . . . . 75.14 109.811 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.0 m -86.84 -40.44 14.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.579 0.228 . . . . 74.54 111.104 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -63.33 125.87 25.57 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.364 0.602 . . . . 75.33 111.804 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.421 HG22 ' HG2' ' A' ' 38' ' ' GLU . 9.6 t -81.85 171.25 14.71 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.737 -0.665 . . . . 73.52 109.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -58.82 -33.48 70.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.887 0.375 . . . . 74.33 110.575 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.43 -41.97 98.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.91 -0.586 . . . . 75.45 110.807 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.421 ' HG2' HG22 ' A' ' 35' ' ' THR . 43.8 mm-40 -71.25 -39.74 71.45 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.966 -0.561 . . . . 71.32 110.466 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.492 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.39 -40.22 96.63 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.669 -0.696 . . . . 71.43 110.823 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.87 -43.76 77.44 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.144 -0.48 . . . . 73.25 111.603 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -58.45 -45.96 87.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.166 0.507 . . . . 62.3 110.287 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.77 -46.56 74.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.5 -0.773 . . . . 64.3 110.563 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.2 mm -56.55 -53.67 38.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.896 -0.593 . . . . 70.03 111.283 -179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.41 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 86.8 m-20 -54.72 -45.27 74.03 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 120.976 0.417 . . . . 75.14 110.664 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.73 -54.14 40.1 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.461 -0.791 . . . . 73.22 112.52 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 50' ' ' ILE . 28.5 m-85 -57.36 -46.1 83.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 111.71 0.263 . . . . 62.54 111.71 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.4 mt -55.17 -42.13 63.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 121.053 0.454 . . . . 75.21 110.871 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.3 mm-40 -74.34 -37.76 63.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.18 -0.464 . . . . 71.3 111.194 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 93.5 mttt -66.84 -33.78 76.37 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.472 -0.331 . . . . 73.23 111.131 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.602 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 89.5 mt -63.55 -43.07 98.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.966 0.412 . . . . 73.01 110.135 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -76.07 -1.67 27.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.068 -0.515 . . . . 75.11 111.139 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.4 t -103.24 -1.96 28.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.101 -0.5 . . . . 74.31 110.118 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.48 2.38 90.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.996 -0.621 . . . . 74.14 113.06 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -68.56 -65.49 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.993 0.425 . . . . 52.34 110.554 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.602 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 61.3 mm-40 -119.64 151.53 38.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.887 -0.597 . . . . 74.35 110.139 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -97.6 152.87 18.61 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.355 -0.609 . . . . 54.54 109.355 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -53.8 -40.09 66.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.527 -0.306 . . . . 75.43 111.711 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -65.85 -19.34 65.84 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 73.03 111.621 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 t -75.44 -38.0 59.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.108 0.48 . . . . 54.54 110.444 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.15 -40.64 13.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.122 -0.49 . . . . 63.45 111.112 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.67 -32.12 68.82 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.131 0.419 . . . . 62.21 112.131 -177.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 28.6 p -82.66 -14.39 54.76 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.248 0.462 . . . . 54.34 112.248 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -124.12 18.23 9.18 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.324 0.49 . . . . 74.53 112.324 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -139.31 -42.06 0.46 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 111.801 0.297 . . . . 64.51 111.801 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.6 m -64.57 132.09 48.86 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.176 0.512 . . . . 74.34 112.365 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.499 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . 20.8 t70 -84.6 -22.46 29.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.791 -0.641 . . . . 74.43 109.444 174.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -59.34 151.44 23.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.218 -0.901 . . . . 73.34 110.984 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.2 m -61.25 -13.12 16.29 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.278 0.473 . . . . 51.41 112.278 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 m -76.87 -6.19 51.41 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.592 -0.276 . . . . 70.35 111.186 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.412 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -55.93 -54.78 40.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.912 0.387 . . . . 72.01 111.337 -178.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -71.69 -8.41 53.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.161 -0.472 . . . . 74.11 110.941 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.78 13.75 32.63 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.913 -0.585 . . . . 42.04 110.174 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 69.91 15.71 7.8 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.267 -0.879 . . . . 71.12 112.57 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.77 -22.17 41.64 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.124 -0.56 . . . . 72.41 113.031 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.24 131.38 49.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.718 0.636 . . . . 74.53 112.718 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.41 -18.39 16.75 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 72.42 111.04 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.61 -175.43 40.56 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 110.898 -0.881 . . . . 51.54 110.898 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.79 122.53 24.2 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.904 0.352 . . . . 63.33 110.732 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -133.91 179.2 6.39 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.341 -0.39 . . . . 64.42 110.399 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -133.21 175.82 9.05 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 120.749 0.309 . . . . 61.04 110.317 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -78.78 156.38 28.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 74.14 111.391 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.402 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 86.01 28.38 28.67 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 116.051 -0.522 . . . . 74.54 111.961 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -127.91 -51.8 1.33 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.748 0.277 . . . . 75.11 111.748 -178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -91.91 175.61 6.82 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.749 0.309 . . . . 45.32 110.793 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -65.28 139.33 58.6 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.762 -0.459 . . . . 73.31 109.762 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.0 tptm -51.37 -52.06 63.07 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 113.456 0.91 . . . . 62.34 113.456 -175.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.6 Cg_endo -53.57 -27.33 40.73 Favored 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.419 2.079 . . . . 64.21 112.906 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -93.28 -50.86 5.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.089 0.471 . . . . 71.41 110.56 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.402 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 35.2 tt0 -61.94 -46.24 90.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.64 -0.709 . . . . 64.52 111.324 -177.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.29 -40.14 89.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.081 -0.509 . . . . 73.45 110.608 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -68.29 -31.97 71.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.874 -0.603 . . . . 74.12 110.804 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 m -68.65 -46.09 70.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.12 -0.491 . . . . 72.54 110.853 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -77.18 -10.23 59.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 74.25 111.619 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.23 8.51 32.74 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.116 0.484 . . . . 63.33 110.496 178.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 79.3 mt -101.57 131.75 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.857 -0.61 . . . . 64.34 110.581 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.5 mtm180 -76.87 172.75 12.63 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.269 -0.423 . . . . 71.44 110.106 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.0 m -55.42 111.88 0.98 Allowed 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.033 0.444 . . . . 74.32 111.868 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.32 49.77 11.42 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.801 -0.636 . . . . 61.35 112.765 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -129.19 156.26 44.22 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.878 0.371 . . . . 62.13 110.995 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.1 ttp -118.3 136.12 53.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.887 -0.597 . . . . 70.5 110.759 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.3 t -83.67 159.54 21.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.017 -0.538 . . . . 65.44 110.902 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.0 -171.09 44.28 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 111.33 -0.708 . . . . 32.25 111.33 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -65.44 107.01 0.93 Allowed 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.872 2.381 . . . . 72.22 112.774 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 91.1 t -89.68 120.56 38.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.63 -0.507 . . . . 55.24 109.63 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -95.85 133.37 40.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.057 0.456 . . . . 71.01 111.226 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 33.9 p -142.88 -173.71 3.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.882 -0.599 . . . . 74.45 110.189 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.46 ' OD1' ' HD2' ' A' ' 22' ' ' ARG . 2.1 p30 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 72.15 111.078 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.9 p -84.43 -41.83 16.24 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.442 . . . . 72.41 110.82 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.89 -149.84 18.67 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 120.696 -0.764 . . . . 60.41 111.945 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.4 mt -98.44 133.01 42.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.72 -0.474 . . . . 70.34 109.72 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -117.03 129.13 55.81 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.276 -0.42 . . . . 62.43 110.698 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.433 HD11 HG23 ' A' ' 43' ' ' ILE . 32.0 mt -107.49 137.5 38.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.784 -1.191 . . . . 60.24 107.784 173.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 24.4 mt -124.88 129.83 73.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.786 -0.366 . . . . 73.35 111.172 -176.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.3 tp -122.71 116.23 23.41 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.257 -0.645 . . . . 74.43 109.257 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -78.35 120.08 22.6 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.366 -0.533 . . . . 75.41 110.87 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 16.7 m -85.63 -60.73 1.94 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.581 -0.736 . . . . 63.12 109.898 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 41.2 mm-40 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.31 -0.852 . . . . 62.45 110.199 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.05 0 N-CA-C 111.396 -0.681 . . . . 71.45 111.396 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -145.15 147.24 32.27 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.726 0.298 . . . . 52.41 110.639 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.95 -14.67 13.92 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.208 0.527 . . . . 73.22 110.487 178.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.432 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 80.1 mtp -116.77 100.28 7.69 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.379 -0.971 . . . . 62.01 108.379 177.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 4' ' ' MET . 0.7 OUTLIER 71.17 156.67 0.16 Allowed Pre-proline 0 N--CA 1.472 0.628 0 O-C-N 123.719 0.637 . . . . 73.15 110.633 -175.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.5 166.74 18.74 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.065 1.843 . . . . 63.34 111.667 178.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.74 -53.89 2.66 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 120.898 0.38 . . . . 65.13 110.843 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HA ' ' OG ' ' A' ' 80' ' ' SER . 35.6 mtm180 -99.34 106.76 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.273 -0.421 . . . . 73.42 110.275 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.7 m -134.81 154.18 36.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-O 121.077 0.465 . . . . 75.35 111.665 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 10' ' ' ARG . 22.9 ttt180 -117.7 137.9 52.37 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.842 -0.799 . . . . 74.55 108.842 174.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.2 m -146.74 148.53 32.05 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.959 0.409 . . . . 75.32 110.933 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.5 m -102.06 148.52 25.28 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.202 -1.036 . . . . 65.31 108.202 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.48 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.8 p80 -136.75 132.21 34.47 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.833 0.679 . . . . 71.24 112.833 -176.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.21 124.8 50.83 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.985 -1.117 . . . . 72.53 107.985 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.478 HD13 ' CD2' ' A' ' 111' ' ' HIS . 28.8 tp -120.8 124.24 44.59 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.02 0.438 . . . . 75.42 111.777 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.85 115.66 50.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.414 -0.812 . . . . 40.55 108.969 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -83.31 175.09 10.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.091 0.472 . . . . 74.3 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -152.12 162.3 41.31 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.832 -0.622 . . . . 74.31 110.048 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -56.28 -49.71 73.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.245 0.545 . . . . 74.01 111.13 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -80.01 40.28 0.47 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.677 -0.692 . . . . 74.01 111.638 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.7 t -105.98 -173.35 2.28 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.285 -0.635 . . . . 72.0 109.285 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 22' ' ' ARG . 36.2 mtp85 -72.44 -23.92 61.14 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.294 0.568 . . . . 75.41 109.722 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' ' H ' ' A' ' 25' ' ' SER . 19.4 ttm180 -146.59 114.13 4.39 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 65.24 110.055 177.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -87.18 21.89 1.0 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.921 2.414 . . . . 62.35 111.631 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.51 ' H ' ' HG2' ' A' ' 23' ' ' ARG . 15.6 m -126.3 148.1 49.6 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.768 -0.651 . . . . 62.1 109.877 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.8 t -146.94 -179.3 6.71 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.875 -0.417 . . . . 44.32 109.875 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 54.9 p-90 -84.71 -35.75 22.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.056 0.455 . . . . 74.22 110.573 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.425 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 3.3 ptm180 -81.0 -21.67 40.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.932 -0.576 . . . . 73.24 110.781 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -151.8 121.86 7.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.883 -0.599 . . . . 75.44 109.48 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.0 -41.69 90.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.307 -0.406 . . . . 74.41 111.345 -176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -122.71 109.24 14.0 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.159 0.504 . . . . 72.53 111.522 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.1 mm -79.04 105.8 8.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.744 -0.836 . . . . 42.44 108.744 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 47.6 p -87.75 -21.89 24.89 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.107 -0.497 . . . . 54.31 112.232 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 34' ' ' ARG . 7.0 ptp85 -66.34 131.77 46.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.074 0.464 . . . . 75.21 111.104 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -86.76 -179.77 6.62 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.921 -0.582 . . . . 74.43 110.258 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.64 -43.31 99.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.68 0.276 . . . . 72.5 110.986 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.58 -40.07 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 74.34 110.869 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.93 -36.49 64.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 73.44 110.715 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.42 94.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.101 -0.5 . . . . 34.14 110.769 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.97 -42.12 93.44 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.385 -0.37 . . . . 72.11 110.91 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -65.73 -42.36 91.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 31.41 110.973 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.43 -52.34 58.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 71.33 110.925 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.7 mm -53.45 -56.5 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 O-C-N 123.457 0.473 . . . . 64.14 111.848 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.582 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 51.0 m-80 -61.99 -36.67 82.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.714 0.292 . . . . 73.14 111.101 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -62.44 -47.03 92.43 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.862 -0.685 . . . . 71.32 111.926 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 50' ' ' ILE . 21.7 m-85 -57.38 -42.39 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.599 0.238 . . . . 74.5 110.907 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.47 -41.95 79.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.144 0.497 . . . . 41.32 110.505 178.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 71.8 mm-40 -66.73 -42.13 86.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.984 -0.553 . . . . 74.32 110.682 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.0 mtpp -58.92 -40.7 85.35 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.186 -0.461 . . . . 65.52 110.703 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 46' ' ' TYR . 82.3 mt -64.89 -42.87 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.703 -0.68 . . . . 74.32 110.996 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -69.09 -33.17 73.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.429 -0.351 . . . . 71.45 111.466 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -78.74 -16.03 57.71 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.01 0.434 . . . . 75.32 110.978 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.72 15.89 67.0 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.848 -0.691 . . . . 61.51 112.45 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -67.61 -58.29 4.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.21 0.529 . . . . 73.13 109.873 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -132.6 143.07 49.44 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.434 -0.803 . . . . 70.3 109.783 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -76.17 157.87 32.28 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 116.185 -0.461 . . . . 75.12 110.787 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -58.59 -43.9 89.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.94 -0.573 . . . . 75.44 109.506 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.387 -0.824 . . . . 70.15 110.488 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.3 t -65.24 -47.02 78.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.951 -0.568 . . . . 74.33 110.163 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.81 -37.16 81.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.004 -0.544 . . . . 70.01 111.075 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -65.53 -48.69 71.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.308 -0.406 . . . . 72.12 111.526 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -76.78 7.92 4.22 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.9 0.704 . . . . 42.23 112.9 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 98.1 mt-30 -135.6 -51.82 0.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.621 0.6 . . . . 71.4 112.621 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -96.27 -10.11 28.69 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.645 0.609 . . . . 64.44 112.645 -174.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 33.1 t -87.04 140.52 29.47 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.717 -0.393 . . . . 63.02 110.389 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.425 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 3.7 m-20 -93.46 13.71 20.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.996 0.427 . . . . 73.11 110.005 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 47.4 t -76.09 146.86 39.03 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.113 -0.494 . . . . 61.54 110.531 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.6 t -75.98 -20.49 57.83 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.854 -0.795 . . . . 73.23 108.854 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.38 -4.72 59.06 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.223 -0.899 . . . . 61.25 110.403 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.75 66.58 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.103 -0.499 . . . . 42.44 111.04 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -61.83 -26.48 68.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.967 -0.56 . . . . 73.24 110.608 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.73 24.44 8.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.941 -0.572 . . . . 65.2 110.135 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 68.2 13.71 9.12 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.911 -0.586 . . . . 72.12 111.274 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.71 12.01 78.48 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.576 -0.821 . . . . 62.02 111.848 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -65.88 126.17 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.923 0.392 . . . . 45.3 111.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -15.38 25.8 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.34 -0.615 . . . . 74.11 109.34 177.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.34 -166.56 48.03 Favored Glycine 0 N--CA 1.433 -1.561 0 C-N-CA 120.745 -0.74 . . . . 75.41 111.382 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -87.43 109.93 19.92 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.801 0.334 . . . . 62.31 110.261 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -116.06 151.36 35.68 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.135 -0.484 . . . . 71.34 109.993 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.402 ' OG ' ' HA ' ' A' ' 8' ' ' ARG . 13.4 m -149.81 177.48 9.77 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.586 -0.279 . . . . 75.54 111.124 -177.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 67.17 10.75 7.95 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.529 -0.759 . . . . 63.32 112.38 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 67.71 31.85 76.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.032 -0.604 . . . . 72.31 112.882 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -82.26 79.05 8.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.155 0.502 . . . . 75.15 110.678 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.5 tpp -178.26 164.0 1.71 Allowed 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.964 -1.016 . . . . 60.2 108.376 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -58.0 139.72 53.88 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.573 0.225 . . . . 74.3 110.572 177.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 53.0 tptt -55.02 -48.63 95.56 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 113.113 0.782 . . . . 62.34 113.113 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 61.1 Cg_exo -53.12 -37.89 80.13 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 121.97 1.78 . . . . 71.04 111.874 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -76.26 -43.79 40.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.42 -0.809 . . . . 74.32 109.707 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.74 -50.21 74.71 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.668 -0.697 . . . . 71.12 111.472 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -54.6 -32.45 58.74 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.958 -0.564 . . . . 73.01 111.867 -177.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -86.77 -42.18 13.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.473 -0.33 . . . . 75.54 111.407 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -64.9 -44.85 88.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.96 0.409 . . . . 75.43 111.66 -177.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -79.13 -0.79 33.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.304 -0.407 . . . . 53.04 111.34 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.63 -2.9 24.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.138 -0.483 . . . . 21.54 110.298 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.3 mt -84.5 140.8 31.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.062 -0.517 . . . . 73.41 110.778 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.99 -174.61 3.02 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.847 -0.615 . . . . 74.11 109.59 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.5 m -72.88 100.9 3.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.933 0.397 . . . . 74.5 110.449 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.23 19.77 20.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.879 -0.677 . . . . 52.3 111.771 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -104.84 147.29 27.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.831 0.348 . . . . 53.31 110.694 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' MET . . . . . 0.424 ' SD ' HD12 ' A' ' 114' ' ' LEU . 56.4 ttp -133.4 135.28 44.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.038 -0.528 . . . . 71.0 110.203 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.478 ' HB2' HD21 ' A' ' 95' ' ' LEU . 16.5 t -92.86 161.62 14.42 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.526 -0.546 . . . . 33.21 109.526 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.11 -144.25 6.89 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 120.648 -0.786 . . . . 64.03 112.19 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.4 103.62 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.501 2.134 . . . . 72.21 112.427 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.72 107.08 19.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.76 -0.459 . . . . 75.25 109.76 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -73.28 112.32 9.23 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.195 0.521 . . . . 71.32 111.037 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 107' ' ' ASP . 1.9 m -120.85 169.47 10.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.588 -0.733 . . . . 54.43 109.48 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.442 ' H ' HG22 ' A' ' 106' ' ' THR . 1.9 m-20 -51.71 -46.45 63.95 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.694 0.627 . . . . 63.12 112.694 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 p -77.7 -16.43 58.48 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.552 0.575 . . . . 54.54 112.552 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 146.15 -158.36 27.67 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.514 -0.851 . . . . 51.21 111.773 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 34.6 mt -87.73 126.2 41.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 120.858 0.361 . . . . 74.22 110.423 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.478 ' CD2' HD13 ' A' ' 15' ' ' LEU . 14.4 m-70 -115.23 133.35 56.11 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.107 -0.497 . . . . 73.13 110.274 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 42.3 mt -101.2 124.34 54.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 N-CA-C 107.606 -1.257 . . . . 70.51 107.606 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.1 mt -112.74 132.78 60.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 C-N-CA 120.813 -0.355 . . . . 75.33 111.32 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.424 HD12 ' SD ' ' A' ' 100' ' ' MET . 8.5 tt -133.65 131.39 39.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.193 -0.458 . . . . 64.43 109.983 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -118.69 130.26 55.74 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.922 -0.399 . . . . 64.32 109.922 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.33 0.57 14.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.858 0.318 . . . . 74.11 111.858 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 118.438 -0.791 . . . . 41.41 110.831 -178.897 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 111.851 -0.5 . . . . 74.22 111.851 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 t -84.4 -57.78 3.01 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.696 0.284 . . . . 70.11 110.438 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -76.14 -42.03 48.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.087 0.47 . . . . 75.22 109.969 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.4 ttt -88.15 111.91 22.13 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.231 -0.655 . . . . 74.42 109.231 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 29.1 mt-10 -68.48 126.09 92.35 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.065 -0.516 . . . . 71.35 110.7 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 36.2 Cg_exo -60.97 152.94 67.37 Favored 'Trans proline' 0 C--O 1.237 0.425 0 C-N-CA 122.827 2.351 . . . . 74.43 112.541 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.61 -19.4 49.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.833 -0.621 . . . . 64.01 109.732 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -133.0 127.41 34.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.404 -0.816 . . . . 64.12 109.912 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.9 m -131.9 166.75 28.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 116.328 -0.397 . . . . 44.45 110.029 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.429 ' H ' ' HB2' ' A' ' 117' ' ' GLU . 58.5 ttt180 -123.75 128.28 49.35 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.699 0.285 . . . . 74.34 110.867 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -134.32 138.72 45.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.856 -0.611 . . . . 62.44 110.518 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.4 m -96.92 158.29 15.5 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.563 -1.273 . . . . 55.52 107.563 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.424 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 10.0 p-80 -147.72 139.34 23.88 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.366 0.876 . . . . 64.02 113.366 -172.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD23 HD12 ' A' ' 112' ' ' ILE . 56.5 tp -116.72 116.48 27.6 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.155 -0.93 . . . . 73.44 108.762 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.672 HD13 ' CE1' ' A' ' 111' ' ' HIS . 16.3 tp -109.66 125.28 52.45 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.888 0.375 . . . . 73.44 110.967 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 p -123.92 136.12 61.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.626 -0.716 . . . . 61.23 109.85 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -84.71 179.7 7.3 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.457 0.646 . . . . 73.23 111.501 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.4 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 6.2 p80 -148.65 153.8 38.8 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.184 -0.917 . . . . 73.15 109.005 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.0 t -44.02 -51.82 7.53 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.997 0.81 . . . . 73.43 112.583 -176.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -90.08 65.31 6.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.092 0.473 . . . . 65.3 111.115 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -110.11 168.8 9.17 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.972 -0.558 . . . . 54.12 109.728 177.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -69.8 -24.92 63.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.159 0.504 . . . . 72.3 110.189 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -153.55 88.8 3.61 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.811 -0.632 . . . . 63.01 109.343 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.5 56.53 6.12 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 123.042 2.495 . . . . 61.43 112.546 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.5 m -137.33 125.23 22.66 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.303 -0.408 . . . . 73.11 110.344 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.5 m -127.4 176.79 7.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.761 0.315 . . . . 61.42 111.622 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -66.99 -31.14 71.51 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.452 0.538 . . . . 65.55 112.452 -178.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -86.61 -62.11 1.58 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.169 0.509 . . . . 73.42 109.791 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -112.35 127.61 56.05 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.612 -0.722 . . . . 73.12 110.809 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -82.01 -14.06 56.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.98 -0.555 . . . . 45.43 110.772 -178.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -123.58 139.44 54.0 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 65.13 109.429 176.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.09 102.26 13.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.958 0.408 . . . . 72.43 110.703 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.1 p -81.43 -41.6 21.61 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.943 -0.571 . . . . 53.14 110.301 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.514 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 8.4 ptt85 -53.09 117.54 3.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.504 -0.771 . . . . 74.12 111.964 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.3 t -82.37 -179.25 7.35 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.872 -0.604 . . . . 65.35 110.639 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -41.11 87.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 63.21 111.065 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.03 -45.47 94.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.421 -0.354 . . . . 72.44 111.051 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 47.5 mt-10 -65.69 -41.62 92.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.06 -0.518 . . . . 74.11 110.434 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.436 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -65.5 -35.77 81.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 72.03 111.148 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.63 -44.49 93.46 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.083 0.468 . . . . 74.5 109.815 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.84 -36.59 80.61 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.84 -0.618 . . . . 62.1 110.208 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.8 mt -62.2 -42.01 98.89 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.321 -0.4 . . . . 75.02 110.048 178.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 39' ' ' ALA . 31.6 mm -54.8 -54.43 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 116.224 -0.444 . . . . 74.02 110.201 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -60.66 -38.35 84.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.771 -0.65 . . . . 71.31 110.373 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -46.92 93.53 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.859 -0.61 . . . . 64.44 111.882 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.2 m-85 -61.39 -50.43 72.91 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.862 -0.422 . . . . 72.41 109.862 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.79 -48.94 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.816 -0.629 . . . . 52.31 111.165 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -39.61 89.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.257 -0.429 . . . . 70.13 111.27 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.48 ' HG3' ' OE1' ' A' ' 54' ' ' GLU . 41.9 tttp -67.27 -36.08 80.83 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 120.899 0.381 . . . . 64.31 110.73 -179.136 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.516 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 91.4 mt -65.28 -47.05 88.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.552 -0.536 . . . . 71.44 109.552 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.77 -15.01 63.39 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.703 -0.681 . . . . 72.23 111.538 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.4 m -80.04 -11.77 59.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.952 0.406 . . . . 72.05 110.411 177.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.16 18.38 74.57 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.788 -0.72 . . . . 65.21 112.01 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE1' ' HG3' ' A' ' 49' ' ' LYS . 48.1 mt-10 -88.9 -68.35 0.78 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.107 0.479 . . . . 74.51 109.811 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 73.8 mm-40 -108.37 147.52 31.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.767 -0.652 . . . . 73.11 109.903 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -93.71 157.52 16.12 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.183 -0.673 . . . . 53.23 109.183 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -36.29 63.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.002 0.43 . . . . 64.15 110.814 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -60.76 -34.81 75.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.736 -0.665 . . . . 72.54 111.093 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.7 t -69.19 -44.76 71.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.171 0.51 . . . . 73.15 109.974 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.81 -45.81 80.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.741 -0.663 . . . . 61.53 110.531 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -70.24 -17.8 63.14 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.892 0.701 . . . . 43.31 112.892 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.7 m -99.01 -24.2 15.0 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.719 0.637 . . . . 64.02 112.719 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -121.27 -28.3 4.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.136 0.791 . . . . 71.13 113.136 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -105.81 5.2 30.6 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.114 0.413 . . . . 74.44 112.114 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -90.97 140.63 29.66 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.654 -0.418 . . . . 71.45 109.946 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -88.8 -1.4 58.07 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.205 0.526 . . . . 64.42 110.559 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB2' HD23 ' A' ' 15' ' ' LEU . 46.9 t -87.5 154.57 20.53 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.956 -0.566 . . . . 53.3 110.474 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 m -74.87 -9.05 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.415 0.626 . . . . 74.31 109.882 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.9 p -74.2 -5.78 43.95 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.499 -0.773 . . . . 74.13 110.93 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -29.0 68.87 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.041 -0.527 . . . . 44.03 109.99 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -68.98 -26.63 65.12 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.539 -0.755 . . . . 64.12 110.3 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.54 16.06 5.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.165 -0.471 . . . . 42.55 110.298 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.0 ttt85 69.0 17.53 8.57 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.601 -0.727 . . . . 75.55 110.434 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.605 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 69.31 29.27 71.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.613 -0.721 . . . . 61.12 113.137 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -124.94 135.31 52.71 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 122.614 -0.345 . . . . 74.12 110.943 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.5 mt -91.35 -11.22 38.53 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 71.21 111.302 -178.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.77 -158.18 49.73 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.405 -0.902 . . . . 33.33 110.908 -176.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.9 117.44 27.9 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.84 0.352 . . . . 52.11 110.505 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -118.06 166.49 12.48 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 109.664 -0.495 . . . . 73.1 109.664 178.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -96.23 170.8 9.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.047 0.451 . . . . 72.22 111.243 -177.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -69.93 132.04 45.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.604 -0.725 . . . . 71.53 110.919 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.42 39.79 25.18 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.918 -0.658 . . . . 70.23 112.126 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -123.62 -4.69 8.19 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.158 0.429 . . . . 74.01 112.158 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 35.4 tpp -125.89 173.96 8.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.666 -0.414 . . . . 54.42 111.29 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -54.55 145.33 18.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.475 -0.33 . . . . 75.11 110.789 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 27.2 tptp -48.39 -54.46 25.7 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 113.457 0.91 . . . . 71.32 113.457 -176.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 29.4 Cg_endo -62.41 -26.79 76.9 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.12 1.88 . . . . 64.13 112.761 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -84.8 -43.23 14.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.144 0.497 . . . . 73.52 109.706 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.5 -50.98 70.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.063 -0.971 . . . . 73.33 110.922 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.18 -48.61 77.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.644 -0.707 . . . . 65.53 111.558 -178.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.72 77.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.186 -0.461 . . . . 72.1 112.043 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.45 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 71.7 m -59.04 -50.82 72.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.776 0.322 . . . . 63.45 111.459 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -79.2 -16.55 56.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.543 -0.299 . . . . 72.44 111.677 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.44 62.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.159 0.504 . . . . 43.22 109.73 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.7 mt -84.71 -171.38 3.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.566 -0.743 . . . . 74.44 109.9 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -148.09 -178.88 6.53 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.178 -0.675 . . . . 75.13 109.178 177.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 116' ' ' THR . 32.5 m -54.53 113.04 1.14 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.595 0.358 . . . . 74.45 111.957 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 97.36 -6.56 63.45 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.935 -0.65 . . . . 61.04 113.621 175.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -90.99 149.7 21.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.146 0.498 . . . . 61.2 111.863 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.6 ttp -131.05 131.51 44.3 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.474 -0.785 . . . . 71.03 110.323 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 95' ' ' LEU . 28.2 t -87.21 168.29 13.35 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.685 -0.487 . . . . 74.21 109.685 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.57 -137.28 5.86 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.804 -0.712 . . . . 73.43 112.532 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.21 108.95 2.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.728 2.285 . . . . 63.0 113.388 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 74.4 t -102.97 104.79 17.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.258 -0.645 . . . . 54.04 109.258 175.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -76.11 122.88 24.93 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.262 -0.426 . . . . 75.32 111.445 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.517 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.6 OUTLIER -127.42 -152.77 0.53 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 116.137 -0.483 . . . . 61.44 109.99 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.517 ' H ' HG22 ' A' ' 106' ' ' THR . 8.7 m-20 -71.4 -65.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.947 0.351 . . . . 75.15 111.947 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 43.3 t -64.15 -42.92 96.58 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.113 -0.494 . . . . 72.35 111.729 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.4 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . -179.28 -145.02 6.05 Favored Glycine 0 N--CA 1.436 -1.312 0 C-N-CA 120.179 -1.01 . . . . 70.25 112.512 -178.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.8 mt -96.54 137.95 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 110.171 -0.307 . . . . 75.1 110.171 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.672 ' CE1' HD13 ' A' ' 15' ' ' LEU . 7.1 m80 -119.59 130.64 55.22 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.396 -0.365 . . . . 62.3 110.826 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.672 HD12 HD23 ' A' ' 14' ' ' LEU . 24.6 mt -101.28 130.88 50.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 107.648 -1.242 . . . . 61.25 107.648 172.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.0 120.24 62.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 112.095 0.406 . . . . 74.54 112.095 -175.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.6 tp -112.84 109.53 19.06 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.971 -0.751 . . . . 73.23 108.971 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 92' ' ' SER . 80.0 ttt180 -85.39 114.87 22.77 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.584 -0.446 . . . . 73.23 110.793 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 97' ' ' THR . 6.9 m -84.16 -44.65 13.77 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.913 -0.585 . . . . 73.44 110.425 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.429 ' HB2' ' H ' ' A' ' 10' ' ' ARG . 32.1 mm-40 . . . . . 0 C--O 1.243 0.726 0 CA-C-O 118.38 -0.819 . . . . 74.42 110.512 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.487 -0.645 . . . . 44.34 111.487 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.5 m -64.85 -30.11 71.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.053 0.454 . . . . 71.42 110.301 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -102.95 154.06 19.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.36 -0.607 . . . . 75.42 109.36 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -102.35 153.11 20.32 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.862 -0.422 . . . . 63.4 109.862 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -81.26 118.46 72.4 Favored Pre-proline 0 C--N 1.309 -1.162 0 N-CA-C 108.83 -0.804 . . . . 63.21 108.83 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -57.7 134.03 60.3 Favored 'Trans proline' 0 N--CA 1.466 -0.102 0 C-N-CA 122.865 2.377 . . . . 62.55 112.59 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.46 -26.3 58.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.951 -0.568 . . . . 54.23 109.571 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -125.73 113.42 17.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 73.43 109.418 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.8 m -111.83 148.4 15.04 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 116.386 -0.37 . . . . 54.03 110.901 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -126.18 129.15 48.44 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.289 -0.414 . . . . 74.04 110.103 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.9 155.57 47.97 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.754 -0.657 . . . . 64.44 110.345 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.2 m -98.35 142.48 29.93 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.973 -1.121 . . . . 74.41 107.973 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.417 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 7.9 p-80 -127.24 129.99 48.79 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.887 0.699 . . . . 71.32 112.887 -175.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HB3' ' HB ' ' A' ' 112' ' ' ILE . 2.9 tm? -105.71 127.32 53.01 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 106.491 -1.67 . . . . 63.25 106.491 175.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.528 HD11 ' O ' ' A' ' 108' ' ' SER . 38.3 tp -125.56 121.08 32.62 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.641 -0.424 . . . . 65.34 111.286 -178.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -137.18 130.81 44.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.507 -0.769 . . . . 65.01 109.729 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 23' ' ' ARG . 51.0 mttp -97.16 -179.97 4.71 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.165 -0.471 . . . . 74.12 111.206 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -153.5 -179.26 7.6 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.447 -0.575 . . . . 65.12 109.447 -179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 p -48.13 -46.15 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.598 0.561 . . . . 75.14 111.843 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -85.34 69.1 10.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.113 0.483 . . . . 75.03 111.51 178.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.9 t -144.99 157.78 44.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.068 -0.716 . . . . 71.24 109.068 176.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.88 -19.54 60.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.94 0.4 . . . . 75.44 111.308 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.41 ' O ' ' HD3' ' A' ' 17' ' ' LYS . 32.6 tpt180 -123.78 94.94 45.28 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.31 -0.404 . . . . 75.24 110.321 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -91.53 28.4 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 123.083 2.522 . . . . 60.33 112.67 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -143.27 128.93 19.23 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.407 -0.36 . . . . 61.23 110.336 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.37 -168.72 1.85 Allowed 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.098 -0.334 . . . . 74.42 110.098 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 66.8 p-90 -86.26 -16.65 36.94 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.026 0.441 . . . . 73.11 110.006 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -100.41 -37.95 8.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 71.31 110.809 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -131.94 117.36 18.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.489 -0.56 . . . . 71.21 109.489 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 63.23 111.888 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -134.24 101.18 4.92 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.045 0.45 . . . . 62.41 110.509 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.18 93.17 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.993 -0.549 . . . . 73.13 110.173 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.9 p -88.8 -16.88 30.98 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.049 -0.523 . . . . 74.43 111.608 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -67.16 124.82 24.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.264 0.554 . . . . 71.31 111.815 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.2 t -84.28 -177.53 6.67 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.72 -0.673 . . . . 60.33 110.923 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -57.82 -42.02 83.44 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 122.794 0.438 . . . . 73.43 111.021 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -57.67 -44.17 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.1 111.328 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 27.1 mm-40 -69.7 -42.16 74.44 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.878 -0.601 . . . . 70.53 110.449 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.51 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.01 -44.24 97.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.662 -0.699 . . . . 72.24 111.482 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -58.47 -45.47 88.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.538 -0.301 . . . . 61.32 111.609 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -61.44 -34.02 74.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.894 0.378 . . . . 75.22 110.816 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.9 mt -72.29 -41.81 66.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.015 -0.539 . . . . 74.41 110.019 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.0 mm -58.65 -47.07 89.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.135 -0.484 . . . . 74.02 109.815 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.549 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 85.8 m-20 -57.48 -43.65 84.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 115.723 -0.672 . . . . 64.24 109.927 178.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.6 -41.28 97.24 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.722 -0.672 . . . . 74.23 112.243 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -61.94 -48.83 78.67 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 109.518 -0.549 . . . . 71.53 109.518 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.83 -42.96 87.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.368 -0.833 . . . . 74.11 110.702 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 81.3 mm-40 -58.52 -48.06 82.1 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 116.299 -0.41 . . . . 73.41 110.902 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -59.54 -41.78 90.83 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.894 0.331 . . . . 42.04 111.894 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 71.9 mt -72.22 -41.47 66.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 74.12 111.844 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -78.11 -40.07 39.37 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 72.03 112.373 -178.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.0 t -73.97 -26.3 60.4 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.596 0.236 . . . . 74.21 110.878 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.44 38.54 5.58 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.573 -0.822 . . . . 54.21 112.074 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.69 -49.55 7.07 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 72.1 110.226 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -143.38 173.7 11.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.787 -0.642 . . . . 63.11 110.305 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -99.15 153.97 18.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.136 -0.484 . . . . 71.04 110.215 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -55.52 -38.16 68.86 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.005 0.431 . . . . 54.41 110.264 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.509 ' OE2' ' HD2' ' A' ' 73' ' ' ARG . 35.5 mt-10 -61.68 -30.67 70.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.644 -0.707 . . . . 72.45 111.283 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.8 t -76.67 -28.93 56.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.347 0.594 . . . . 74.51 110.453 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -87.84 -47.94 8.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.781 -0.645 . . . . 64.31 111.081 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -19.98 64.03 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.925 0.713 . . . . 71.12 112.925 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.686 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 2.7 p -76.65 -20.79 56.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.196 0.813 . . . . 72.32 113.196 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -128.77 -22.53 3.24 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.931 0.715 . . . . 74.52 112.931 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -91.56 -10.85 39.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.658 0.614 . . . . 72.42 112.658 -177.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 34.3 m -84.41 136.21 33.96 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.998 -0.281 . . . . 61.3 110.244 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -84.96 -11.8 54.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.306 0.574 . . . . 53.02 109.913 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.466 ' HB2' HD23 ' A' ' 15' ' ' LEU . 30.9 t -79.6 159.7 26.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.317 -0.856 . . . . 74.02 110.89 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 17.0 m -70.05 -19.0 63.31 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.161 -0.472 . . . . 64.55 110.138 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.9 m -67.67 -5.03 13.87 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.969 -0.56 . . . . 64.13 111.421 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -51.99 -51.15 59.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.185 -0.461 . . . . 74.32 111.285 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.88 4.44 9.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.116 0.413 . . . . 64.05 112.116 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.3 12.34 37.33 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.964 -0.754 . . . . 71.32 108.964 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.509 ' HD2' ' OE2' ' A' ' 58' ' ' GLU . 75.9 mtm180 69.33 16.4 8.36 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.791 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.49 3.43 90.53 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.002 -0.618 . . . . 70.42 113.316 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -73.72 134.6 43.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.085 0.469 . . . . 71.43 111.025 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.518 ' O ' HD23 ' A' ' 76' ' ' LEU . 4.1 tt -101.69 -19.64 15.32 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.782 -0.821 . . . . 75.03 108.782 178.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.44 -176.38 48.2 Favored Glycine 0 N--CA 1.437 -1.272 0 CA-C-N 115.56 -0.745 . . . . 63.13 111.628 -178.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.04 131.98 34.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 120.748 0.309 . . . . 75.2 110.235 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -133.27 154.44 50.68 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.913 -0.585 . . . . 72.34 110.02 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 p -95.56 -80.85 0.41 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 111.989 0.366 . . . . 72.31 111.989 -177.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -161.64 136.97 7.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 72.31 110.842 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.57 15.93 76.87 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.748 -0.66 . . . . 74.31 111.474 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -103.87 -36.38 7.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 71.45 110.824 -176.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.5 tpp -121.23 157.56 30.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.205 -0.452 . . . . 72.13 109.996 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -48.03 135.7 12.43 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 123.38 0.425 . . . . 73.41 111.464 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.499 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 12.7 tmtt? -48.6 -52.48 44.11 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 115.64 -0.709 . . . . 50.24 112.635 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.1 Cg_endo -53.54 -24.14 27.78 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.619 2.212 . . . . 50.12 113.413 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.561 ' CD2' HG12 ' A' ' 113' ' ' ILE . 31.1 t80 -99.42 -53.36 3.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.056 0.455 . . . . 74.32 110.586 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -59.86 -48.08 83.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.52 -0.764 . . . . 60.53 111.386 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -60.76 -45.09 95.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.115 -0.493 . . . . 73.42 111.683 -178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.92 66.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 51.52 111.351 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -65.84 -24.16 66.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.237 -0.438 . . . . 45.52 111.668 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -81.84 -27.51 33.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.412 . . . . 73.02 110.542 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.61 -28.08 37.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.863 -0.608 . . . . 73.45 110.887 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.41 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -82.68 133.22 35.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.067 -0.515 . . . . 74.12 110.546 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -97.09 169.41 9.83 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.322 -0.399 . . . . 64.03 109.97 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.9 m -55.89 111.28 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.302 -0.408 . . . . 62.04 111.158 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.31 -13.28 23.54 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.692 -0.766 . . . . 42.21 112.691 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -91.0 154.63 19.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.908 0.385 . . . . 72.2 110.958 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.8 ttp -142.23 130.23 21.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.127 -0.488 . . . . 74.11 110.427 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.41 ' HB2' HD11 ' A' ' 95' ' ' LEU . 38.0 t -78.86 157.46 28.32 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.075 -0.512 . . . . 73.4 110.321 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.18 -155.88 22.78 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.811 -0.709 . . . . 72.1 111.776 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.02 105.73 1.41 Allowed 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.636 2.224 . . . . 74.44 113.232 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.2 110.8 21.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.921 -0.77 . . . . 74.24 108.921 175.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -83.92 122.47 28.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.214 -0.448 . . . . 63.52 111.937 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.5 p -142.45 178.57 7.51 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.793 -0.639 . . . . 73.55 109.779 178.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.21 -31.98 70.94 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.036 0.446 . . . . 73.55 110.865 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.528 ' O ' HD11 ' A' ' 15' ' ' LEU . 11.8 p -79.74 4.97 14.66 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.63 -0.713 . . . . 75.24 111.33 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.85 -158.44 14.28 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.845 -0.693 . . . . 70.01 112.389 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.4 mt -97.93 128.12 49.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 N-CA-C 109.837 -0.431 . . . . 74.23 109.837 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -110.9 125.54 53.76 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.496 -0.32 . . . . 75.24 110.812 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.466 ' HB ' ' HB3' ' A' ' 14' ' ' LEU . 59.0 mt -102.17 130.67 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.458 -0.942 . . . . 54.14 108.458 174.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' CD2' ' A' ' 88' ' ' PHE . 11.0 mt -110.79 107.43 22.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.652 -0.249 . . . . 73.01 111.202 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.9 tt -104.75 114.81 29.25 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.174 -0.676 . . . . 71.44 109.174 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -79.39 108.39 12.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.222 -0.444 . . . . 71.51 110.261 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.2 p -95.07 -64.07 1.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.644 0.979 . . . . 75.53 113.644 -176.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.344 -0.836 . . . . 74.42 111.765 -174.901 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 112.216 -0.354 . . . . 44.14 112.216 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.1 t -62.78 112.48 2.55 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 122.489 0.316 . . . . 72.24 110.322 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -71.43 144.11 49.87 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.811 -0.356 . . . . 73.32 110.265 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.02 175.73 10.12 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.073 -0.512 . . . . 64.4 110.025 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -91.53 107.57 22.92 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.559 -0.904 . . . . 53.3 108.559 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.77 139.37 33.5 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.564 2.176 . . . . 73.35 112.669 -176.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.07 -16.63 37.48 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.292 0.568 . . . . 70.34 109.877 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.6 mtt180 -107.07 117.51 34.26 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.257 -0.883 . . . . 74.24 110.021 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.3 m -124.54 148.66 28.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 CA-C-N 116.165 -0.471 . . . . 73.24 110.366 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.4 ttt180 -103.54 109.06 20.58 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 110.043 -0.355 . . . . 70.12 110.043 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.8 m -128.88 132.78 47.74 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.299 0.571 . . . . 74.14 111.318 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 6.8 m -98.1 142.77 29.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 108.247 -1.02 . . . . 54.52 108.247 176.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.493 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -133.91 129.06 35.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.452 0.908 . . . . 64.35 113.452 -176.58 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.4 tt -106.78 142.61 36.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 107.645 -1.243 . . . . 75.24 107.645 174.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.545 HD23 ' HB2' ' A' ' 67' ' ' SER . 46.0 tp -123.75 134.05 53.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.883 0.327 . . . . 75.53 111.883 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.414 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 14.4 p -117.64 132.62 66.93 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-N 115.758 -0.655 . . . . 70.13 109.944 175.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.89 158.24 16.88 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.956 0.408 . . . . 73.34 110.171 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -139.98 158.25 44.36 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.11 -0.496 . . . . 75.12 109.735 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.2 t -43.76 -59.88 2.04 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.98 0.8 . . . . 74.43 112.356 -177.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -92.02 66.84 5.04 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.053 0.454 . . . . 71.34 111.12 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 t -116.0 173.74 6.41 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.067 -0.515 . . . . 75.1 109.621 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -56.51 -57.21 13.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 53.3 109.879 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -126.55 97.96 32.69 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 109.37 -0.604 . . . . 72.55 109.37 175.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -73.73 50.57 2.09 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.387 2.725 . . . . 60.3 112.295 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -140.82 152.39 45.13 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 116.038 -0.528 . . . . 53.22 110.172 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.3 p -154.99 -176.4 5.92 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.358 -0.608 . . . . 60.35 109.358 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -82.64 -3.38 56.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.352 0.596 . . . . 72.33 109.589 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 58.9 mtp180 -104.99 -43.64 5.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.791 . . . . 74.22 110.078 -178.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.448 ' HB3' HD13 ' A' ' 32' ' ' ILE . 62.8 tt0 -142.92 118.34 10.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.866 -0.606 . . . . 74.23 109.894 -178.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.36 -29.27 63.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.926 0.393 . . . . 70.25 111.164 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -123.1 94.11 4.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.232 0.539 . . . . 74.52 110.241 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 29' ' ' GLN . 42.6 mm -68.73 104.01 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.501 -0.772 . . . . 53.14 111.39 -178.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.54 -24.07 20.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.044 -0.525 . . . . 74.21 111.001 177.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HG2' ' H ' ' A' ' 34' ' ' ARG . 4.5 ptt180 -60.64 118.22 6.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.898 -0.592 . . . . 75.4 110.303 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t -85.15 -174.72 5.4 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.767 -0.651 . . . . 74.53 112.098 -175.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -57.58 -50.62 72.52 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.559 -0.746 . . . . 70.02 111.482 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -52.2 -44.01 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.207 -0.451 . . . . 65.55 111.295 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.562 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 38.8 mt-10 -67.55 -51.14 54.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.9 -0.591 . . . . 72.14 110.694 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.1 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.02 -0.536 . . . . 51.22 111.145 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.0 tp -61.93 -44.3 97.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 71.11 110.722 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -70.27 -33.82 72.04 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.416 -0.356 . . . . 71.15 111.097 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.6 mt -62.3 -48.35 80.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.988 -0.375 . . . . 72.21 109.988 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.468 HG23 HG12 ' A' ' 112' ' ' ILE . 29.6 mm -54.08 -60.49 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-N 115.772 -0.649 . . . . 73.23 111.302 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -63.8 -28.91 70.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 74.21 111.0 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.479 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -64.43 -54.72 27.58 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 111.609 -0.597 . . . . 70.22 111.609 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.46 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.3 m-85 -56.73 -45.15 82.13 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.005 -0.368 . . . . 72.23 110.005 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.465 ' CD1' ' HA2' ' A' ' 102' ' ' GLY . 78.6 mt -54.98 -47.76 76.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.798 -0.637 . . . . 51.15 110.843 178.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -64.61 -40.13 94.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 63.41 110.756 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.3 mtpp -64.39 -39.83 94.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.96 0.409 . . . . 74.2 110.692 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 46' ' ' TYR . 88.4 mt -68.87 -46.91 78.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.21 -0.45 . . . . 74.13 110.637 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -62.17 -29.08 70.11 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.307 -0.406 . . . . 72.54 112.04 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 m -77.41 -9.04 58.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.828 0.347 . . . . 72.12 110.76 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 3.33 83.35 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.002 -0.618 . . . . 75.33 112.288 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -73.78 -62.54 1.46 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.992 0.425 . . . . 63.43 110.783 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HG3' ' HE3' ' A' ' 49' ' ' LYS . 24.3 mm-40 -101.92 167.15 10.24 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.066 -0.516 . . . . 72.11 110.682 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -119.66 140.41 50.67 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.531 -0.544 . . . . 53.45 109.531 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -57.32 -55.6 32.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.8 0.296 . . . . 63.43 111.8 -177.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.405 ' OE2' ' HD3' ' A' ' 73' ' ' ARG . 47.8 mt-10 -53.14 -42.52 66.16 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.686 0.279 . . . . 75.31 111.351 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.6 m -64.39 -47.28 79.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.294 -0.412 . . . . 72.35 110.93 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.89 -43.29 79.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 74.12 111.016 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.618 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -68.53 -10.85 58.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.142 -0.481 . . . . 75.22 112.273 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.481 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 70.5 m -88.38 -13.19 41.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.775 0.322 . . . . 75.45 111.267 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -128.62 -36.41 1.85 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.7 0.63 . . . . 64.52 112.7 -177.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.81 9.1 38.59 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.4 0.518 . . . . 73.5 112.4 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -92.09 114.45 26.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.708 -0.397 . . . . 65.31 110.06 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.452 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 59.5 m-20 -78.76 51.3 1.08 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.256 0.55 . . . . 61.35 110.781 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.545 ' HB2' HD23 ' A' ' 15' ' ' LEU . 26.0 t -164.61 178.19 7.51 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.676 -0.693 . . . . 71.24 109.355 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -67.06 -14.06 62.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.97 0.414 . . . . 51.43 110.713 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.5 m -56.11 -24.77 42.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.738 -0.665 . . . . 75.01 111.024 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.618 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -61.11 -30.29 70.27 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.923 -0.58 . . . . 62.35 111.725 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -83.44 -11.46 57.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.063 0.459 . . . . 71.11 111.043 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.48 13.81 18.94 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.205 -0.452 . . . . 70.44 111.248 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.405 ' HD3' ' OE2' ' A' ' 58' ' ' GLU . 83.2 mtt180 64.03 11.19 5.94 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.305 -0.407 . . . . 75.24 111.724 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.39 -25.08 3.35 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 121.053 -0.594 . . . . 62.45 112.606 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 13.0 t0 -77.91 126.61 31.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.063 0.459 . . . . 75.22 111.421 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -103.42 -4.75 23.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.726 -0.67 . . . . 70.35 110.776 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 78.13 -165.32 51.96 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.194 -1.003 . . . . 70.35 110.924 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.22 119.26 22.75 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.877 -0.416 . . . . 72.31 109.877 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 29.4 p90 -127.4 162.7 25.7 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.229 -0.442 . . . . 72.52 110.83 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.9 t -82.94 135.63 34.83 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.93 -0.577 . . . . 73.31 109.816 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.401 ' HD3' ' CZ ' ' A' ' 93' ' ' PHE . 31.0 ptt180 -57.35 -31.49 65.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.898 -0.592 . . . . 74.02 111.939 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.82 73.1 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.662 -0.78 . . . . 53.05 112.222 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.6 16.37 17.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.957 0.408 . . . . 71.54 109.966 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.2 tpp -130.39 154.18 47.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.04 -0.527 . . . . 73.43 110.635 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.403 ' OE1' ' HA ' ' A' ' 85' ' ' GLN . 16.0 mm-40 -60.46 144.26 51.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.529 -0.305 . . . . 62.32 110.566 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.477 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 48.2 tptt -59.46 -50.4 87.43 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 113.093 0.775 . . . . 72.23 113.093 -176.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 16.9 Cg_endo -58.76 -35.43 98.64 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 121.79 1.66 . . . . 75.21 111.445 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -68.57 -44.37 74.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.582 -0.736 . . . . 73.43 109.174 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.46 -48.59 80.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.605 -0.725 . . . . 71.4 110.158 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -55.58 -42.77 75.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.503 -0.771 . . . . 63.04 111.4 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -70.99 -40.7 71.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.327 -0.397 . . . . 71.15 110.91 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 m -62.87 -45.22 93.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.039 0.447 . . . . 63.53 111.328 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.401 ' CZ ' ' HD3' ' A' ' 81' ' ' ARG . 13.1 m-85 -78.65 -6.24 55.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.098 -0.501 . . . . 74.51 111.587 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.67 -26.3 21.92 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.252 -0.647 . . . . 74.32 109.252 175.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 101' ' ' SER . 91.0 mt -86.43 179.71 6.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.195 -0.911 . . . . 73.33 110.787 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -130.21 176.65 7.93 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.548 -0.751 . . . . 74.24 109.542 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.4 m -61.05 110.16 1.28 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.012 0.434 . . . . 64.45 111.035 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.39 16.22 32.74 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 121.023 -0.608 . . . . 55.41 112.502 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -109.72 148.17 31.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.849 0.357 . . . . 72.44 111.237 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.3 ttp -128.63 127.96 43.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.027 -0.533 . . . . 65.04 110.473 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.454 ' HB2' HD11 ' A' ' 95' ' ' LEU . 32.1 t -83.05 161.42 21.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.031 -0.531 . . . . 63.25 110.823 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.465 ' HA2' ' CD1' ' A' ' 47' ' ' ILE . . . -84.98 -139.02 4.47 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 115.938 -0.574 . . . . 44.23 112.405 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.58 106.15 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.821 2.347 . . . . 72.11 112.665 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.96 123.24 67.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 61.2 110.483 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -97.12 124.75 41.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.2 -0.455 . . . . 71.01 109.872 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.2 p -113.5 -60.56 1.87 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.364 0.505 . . . . 51.21 112.364 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -144.57 -53.01 0.31 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.382 0.512 . . . . 71.31 112.382 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 m -113.53 -53.67 2.67 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.944 0.35 . . . . 74.23 111.944 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.38 -169.38 12.61 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 119.973 -1.108 . . . . 63.05 112.733 -177.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.7 mt -90.78 138.49 19.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.501 -0.555 . . . . 73.13 109.501 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.543 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 72.9 m-70 -119.89 145.31 46.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.765 0.317 . . . . 61.14 111.373 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 50.0 mt -100.95 117.35 46.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.469 -1.308 . . . . 74.11 107.469 173.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 62.6 mt -103.72 110.9 31.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 120.92 0.39 . . . . 73.51 111.724 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.8 tp -106.09 107.4 18.38 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.815 -0.63 . . . . 72.43 109.842 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -85.19 100.22 11.61 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.686 -0.487 . . . . 74.13 109.686 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.2 m -74.15 -38.18 63.8 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.686 -0.688 . . . . 74.24 110.56 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.257 1.447 0 CA-C-O 118.518 -0.753 . . . . 73.21 110.318 -178.714 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.021 -0.432 . . . . 45.03 112.021 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -79.26 159.45 27.26 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.128 -0.323 . . . . 64.15 110.128 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -68.19 -39.53 82.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 109.63 -0.508 . . . . 75.42 109.63 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.4 ttp -96.43 88.56 4.76 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.216 -1.031 . . . . 62.34 108.216 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -126.3 118.49 23.35 Favored Pre-proline 0 C--N 1.312 -1.022 0 CA-C-N 116.018 -0.537 . . . . 72.53 110.679 -176.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.55 133.2 50.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.775 2.317 . . . . 74.22 111.895 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.27 -24.73 25.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.89 -0.596 . . . . 63.34 110.214 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -113.24 127.04 56.04 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.602 -0.727 . . . . 72.02 109.784 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.1 m -125.58 143.65 38.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 CA-C-N 116.263 -0.426 . . . . 72.34 110.514 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 60.6 ttt180 -112.27 122.92 49.08 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.623 -0.51 . . . . 55.12 109.623 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -134.53 167.64 20.42 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.101 0.476 . . . . 52.53 111.049 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -122.37 145.33 48.37 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.486 -0.931 . . . . 53.12 108.486 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -124.06 129.44 50.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.448 -0.501 . . . . 74.14 112.304 -176.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.652 HD23 HD12 ' A' ' 112' ' ' ILE . 38.4 tp -106.2 119.11 38.37 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 108.506 -0.924 . . . . 74.22 108.506 176.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.62 HD13 ' NE2' ' A' ' 111' ' ' HIS . 13.8 tp -116.84 120.17 37.68 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.15 0.5 . . . . 63.02 111.326 -178.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.7 t -118.47 105.92 18.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.0 -1.0 . . . . 74.14 108.312 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -76.48 168.85 19.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.497 0.665 . . . . 73.2 111.803 -177.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.437 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 2.0 p80 -139.26 156.26 47.19 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.134 -0.939 . . . . 64.41 109.828 -178.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 p -51.34 -38.02 50.93 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 123.834 0.709 . . . . 72.21 112.059 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -74.05 29.96 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.659 0.614 . . . . 73.41 112.659 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.4 t -113.16 179.42 3.97 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.972 -0.751 . . . . 75.32 108.972 177.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.416 HH12 ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -83.27 -29.4 28.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.933 0.397 . . . . 71.34 110.364 -179.733 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -111.19 102.0 51.79 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.098 -0.501 . . . . 74.21 110.43 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.446 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 66.1 Cg_endo -92.03 34.26 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.998 2.465 . . . . 74.13 111.712 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.5 p -149.76 158.07 43.82 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.925 0.393 . . . . 74.43 111.054 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.9 p -148.27 -161.6 1.37 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 72.41 109.667 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 70.2 p-90 -89.76 -5.58 56.82 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.916 0.389 . . . . 72.13 110.584 178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -130.71 0.13 4.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.255 -0.43 . . . . 63.33 111.73 -177.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -148.36 128.72 13.88 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.697 -0.483 . . . . 70.43 109.697 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.7 -31.34 32.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.495 -0.321 . . . . 75.14 111.068 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 20.9 ptmt -140.57 106.93 5.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.391 0.615 . . . . 73.55 111.551 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.6 mm -67.79 102.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.825 -0.805 . . . . 63.05 108.825 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 m -97.68 -11.44 23.5 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.92 -0.582 . . . . 70.24 110.674 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -74.7 129.41 37.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.021 -0.536 . . . . 74.1 110.287 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.477 HG22 ' OE1' ' A' ' 38' ' ' GLU . 9.0 t -87.24 -178.66 6.26 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 120.759 -0.376 . . . . 62.34 110.027 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -62.87 -44.46 96.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.841 -0.163 . . . . 61.32 111.426 -177.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.7 mp0 -57.04 -44.18 82.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.416 -0.356 . . . . 72.12 110.567 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.477 ' OE1' HG22 ' A' ' 35' ' ' THR . 42.1 mt-10 -66.97 -43.87 81.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.847 -0.615 . . . . 55.34 110.727 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.49 -41.21 98.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.015 -0.539 . . . . 74.12 110.584 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.86 -42.1 92.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.903 -0.59 . . . . 75.21 110.05 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 50.3 mm-40 -58.39 -41.57 85.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 73.13 110.474 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.04 -40.73 87.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.856 -0.611 . . . . 52.12 110.036 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.5 mm -53.55 -49.47 55.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.674 -0.694 . . . . 61.11 111.066 179.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -55.23 -47.07 75.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.162 0.506 . . . . 73.33 110.191 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -57.33 -47.29 89.04 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.437 -0.801 . . . . 51.23 112.257 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.3 m-85 -59.94 -52.3 66.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.347 0.118 . . . . 74.1 110.948 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -56.22 -45.95 81.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.023 0.439 . . . . 75.32 110.705 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -66.21 -42.01 89.35 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.887 -0.597 . . . . 75.41 112.142 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 30.0 mtpp -63.58 -37.98 89.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.621 0.248 . . . . 64.15 111.491 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 46' ' ' TYR . 79.0 mt -66.33 -48.16 81.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.39 -0.368 . . . . 55.43 110.718 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -69.98 -18.49 63.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.345 -0.389 . . . . 63.5 111.924 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -91.12 1.05 57.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.912 0.387 . . . . 71.23 110.741 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.08 30.27 69.98 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.999 -0.546 . . . . 75.12 113.363 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -92.11 -53.13 4.38 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.506 -0.408 . . . . 72.32 110.655 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 39.3 mt-10 -137.1 148.02 46.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.08 -0.509 . . . . 74.21 110.077 178.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -81.89 160.82 23.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.149 -0.478 . . . . 73.1 111.093 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -62.81 -53.9 47.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.935 -0.575 . . . . 75.03 110.582 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 2.8 mp0 -58.45 -31.24 67.6 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 65.12 110.509 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 29.7 t -67.23 -52.07 45.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.758 -0.656 . . . . 63.31 109.652 178.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.24 -33.88 76.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.398 -0.365 . . . . 73.41 110.858 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -63.89 -32.44 73.96 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.033 -0.53 . . . . 75.03 111.46 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -95.76 5.72 50.68 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.987 0.423 . . . . 73.51 111.225 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' SER . 27.8 mt-30 -115.43 -53.96 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.193 0.442 . . . . 64.13 112.193 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -108.88 -6.76 15.64 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.661 0.986 . . . . 43.54 113.661 -173.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.445 ' HB2' HD12 ' A' ' 14' ' ' LEU . 11.7 t -78.83 136.92 37.47 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.022 -0.671 . . . . 61.22 110.599 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -95.63 11.61 32.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.847 -0.615 . . . . 75.33 110.367 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 48.3 t -81.81 145.2 30.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.699 -0.682 . . . . 63.44 110.146 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 p -62.4 -26.3 68.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.073 0.463 . . . . 54.02 110.983 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 m -74.94 -4.99 41.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.73 -0.668 . . . . 65.15 111.81 -178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.06 65.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.815 0.34 . . . . 71.43 111.187 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -32.63 74.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.231 0.539 . . . . 74.33 110.624 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.33 16.36 11.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.849 -0.614 . . . . 73.11 110.19 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.493 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 12.3 mpt_? 67.45 14.16 9.54 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.402 -0.817 . . . . 73.35 111.94 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.35 7.65 88.34 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.738 -0.744 . . . . 44.02 112.806 179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -80.02 136.95 36.7 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.828 0.347 . . . . 61.23 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 mp -101.49 -21.2 14.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.161 -0.472 . . . . 43.2 110.109 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.96 -171.04 42.3 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.772 -0.931 . . . . 42.01 110.772 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.05 107.93 10.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 117.187 0.494 . . . . 64.24 110.182 179.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.0 p90 -123.59 -174.37 2.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.192 -0.458 . . . . 72.1 110.756 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -148.87 -165.89 2.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.247 -0.649 . . . . 72.01 109.247 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -66.63 134.43 52.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.033 0.444 . . . . 73.53 111.769 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.447 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 102.91 22.91 8.97 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.878 -0.601 . . . . 61.34 112.375 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -122.99 -34.81 3.11 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.33 0.493 . . . . 54.51 112.33 -177.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.1 tpp -135.73 171.33 14.61 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.812 -0.355 . . . . 53.03 111.207 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -55.58 141.61 36.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.315 -0.402 . . . . 72.42 110.273 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.407 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 86.4 tttt -51.96 -48.57 87.76 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.195 0.813 . . . . 71.02 113.195 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 73.3 Cg_exo -51.51 -28.79 29.53 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.209 1.939 . . . . 71.44 113.03 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CD2' HG12 ' A' ' 113' ' ' ILE . 48.1 t80 -95.48 -49.88 5.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.324 0.583 . . . . 74.45 110.387 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 34.7 tt0 -61.21 -50.22 73.96 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.324 -0.853 . . . . 63.01 111.557 -176.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.48 -39.64 95.0 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.899 0.381 . . . . 65.1 111.05 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.61 -32.26 73.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.863 -0.608 . . . . 54.54 111.231 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -60.19 -31.77 70.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.177 -0.465 . . . . 72.31 111.294 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -86.81 -19.49 28.93 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.26 -0.427 . . . . 74.22 110.526 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.93 -42.93 15.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 74.13 111.395 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 69.8 mt -81.79 145.08 30.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.058 -0.519 . . . . 74.25 110.334 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.517 ' CG ' ' HG2' ' A' ' 99' ' ' GLU . 28.7 ptt180 -80.66 176.9 9.39 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.814 -0.439 . . . . 74.44 109.814 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -66.71 114.43 5.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.131 -0.486 . . . . 62.21 110.821 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.39 6.8 38.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.504 -0.855 . . . . 61.11 113.814 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.517 ' HG2' ' CG ' ' A' ' 96' ' ' ARG . 63.1 mm-40 -88.32 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.387 0.594 . . . . 73.13 111.905 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.9 tpp -104.44 128.47 52.34 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.163 -0.926 . . . . 74.01 109.261 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.43 ' CB ' ' HB ' ' A' ' 113' ' ' ILE . 32.8 t -91.74 156.37 17.61 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 116.454 -0.339 . . . . 75.32 110.223 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.65 -168.2 38.46 Favored Glycine 0 N--CA 1.44 -1.059 0 C-N-CA 120.754 -0.736 . . . . 41.43 111.525 178.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -66.13 102.46 0.56 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.78 2.32 . . . . 75.31 112.35 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.3 110.95 24.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 60.23 109.675 178.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -78.08 110.87 13.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.018 -0.537 . . . . 65.43 111.004 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 m -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.891 -0.781 . . . . 74.13 108.891 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.416 ' HB2' HH12 ' A' ' 22' ' ' ARG . 7.1 p-10 -60.1 -32.63 71.16 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.082 0.401 . . . . 74.31 112.082 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 p -79.36 -35.58 40.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.1 0.476 . . . . 54.22 111.602 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.437 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . 167.97 -162.88 36.68 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 110.863 -0.895 . . . . 72.4 110.863 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.452 HG21 HG13 ' A' ' 43' ' ' ILE . 31.8 mt -87.64 131.75 34.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 109.782 -0.451 . . . . 74.21 109.782 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.62 ' NE2' HD13 ' A' ' 15' ' ' LEU . 14.3 m-70 -121.47 139.65 53.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.282 -0.417 . . . . 74.31 111.163 -178.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.652 HD12 HD23 ' A' ' 14' ' ' LEU . 21.9 mt -109.34 139.5 31.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.15 -1.056 . . . . 74.12 108.15 173.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.507 HG12 ' CD2' ' A' ' 88' ' ' PHE . 23.5 mt -114.68 129.55 70.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 120.744 0.306 . . . . 53.31 111.606 -175.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -133.2 119.58 20.05 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 174.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -84.2 108.26 16.99 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.99 0.424 . . . . 65.22 109.938 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 m -70.18 -51.96 27.09 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.626 -0.715 . . . . 62.12 110.241 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.427 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 75.0 mm-40 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.39 -0.814 . . . . 61.44 109.51 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.443 0 N-CA-C 111.709 -0.556 . . . . 75.41 111.709 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 p -64.42 -50.14 68.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.201 0.525 . . . . 64.33 110.792 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -114.17 98.18 6.8 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 74.34 110.326 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.5 ttm -130.42 115.0 16.25 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.841 -0.618 . . . . 74.33 110.463 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 1.7 mp0 -63.69 141.92 97.97 Favored Pre-proline 0 C--N 1.313 -0.991 0 CA-C-N 115.618 -0.719 . . . . 74.41 110.305 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.32 133.45 43.4 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.682 2.255 . . . . 63.44 111.846 179.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.64 -47.94 68.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.885 0.374 . . . . 62.45 110.625 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -109.97 96.12 6.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.453 -0.573 . . . . 73.0 109.453 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.2 p -109.92 145.33 16.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 116.205 -0.452 . . . . 51.31 110.793 -177.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HB3' ' HG3' ' A' ' 117' ' ' GLU . 78.8 ttt180 -109.74 120.44 42.49 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.237 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -134.3 154.47 51.3 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.946 -0.57 . . . . 62.45 110.403 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 m -98.37 149.26 22.83 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.255 -1.017 . . . . 63.53 108.255 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.561 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -148.06 136.96 21.89 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.283 0.564 . . . . 74.21 112.51 -176.677 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.5 tt -106.98 140.77 39.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.271 -0.877 . . . . 70.42 108.817 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -132.91 127.08 33.54 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 110.054 -0.35 . . . . 61.04 110.054 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -122.27 127.83 75.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.018 0.437 . . . . 71.41 110.173 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -91.82 171.8 8.9 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.236 0.541 . . . . 52.41 111.032 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -152.37 163.03 40.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.87 -0.604 . . . . 73.13 109.848 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.8 t -54.64 -41.63 70.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.253 0.549 . . . . 74.35 110.189 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.01 62.31 6.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.873 -0.603 . . . . 74.1 110.113 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.0 t -135.17 165.17 26.01 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.458 -0.571 . . . . 62.41 109.458 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 73.7 mtm180 -63.2 -34.31 77.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.225 0.536 . . . . 73.51 110.116 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -129.98 89.49 45.5 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 115.917 -0.583 . . . . 74.52 110.47 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.43 72.63 5.9 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.657 2.238 . . . . 53.31 111.167 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -157.36 143.4 17.7 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.964 -0.562 . . . . 60.23 109.941 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.4 p -144.84 172.58 12.82 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.684 0.278 . . . . 72.5 110.551 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -88.68 -5.19 58.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.412 0.625 . . . . 75.0 109.434 177.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 43.0 mtp180 -98.63 -48.36 5.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.097 -0.956 . . . . 75.24 111.087 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -114.63 146.93 40.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.152 -0.477 . . . . 73.35 110.56 -175.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -83.58 -47.22 11.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 74.55 110.25 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -121.42 116.96 25.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.381 -0.6 . . . . 51.34 109.381 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.6 mm -75.98 94.02 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.176 -0.465 . . . . 72.24 111.442 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 m -87.54 -25.59 23.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.279 0.562 . . . . 73.32 110.096 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HA ' ' OE2' ' A' ' 38' ' ' GLU . 9.1 ptt180 -60.43 119.47 8.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.362 -0.836 . . . . 73.33 111.834 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -80.72 -178.14 6.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.878 -0.601 . . . . 55.22 110.644 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.16 -35.19 79.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.466 -0.334 . . . . 75.12 110.504 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -64.01 -43.16 96.47 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.3 -0.409 . . . . 62.31 110.976 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 42.4 mt-10 -62.7 -41.37 99.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 74.22 110.653 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.505 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.11 -40.3 97.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.134 -0.484 . . . . 63.22 110.21 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.67 -42.46 91.3 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.7 -0.682 . . . . 63.45 109.974 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -59.54 -42.08 91.5 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.276 -0.42 . . . . 75.23 110.595 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.8 mt -62.04 -45.85 91.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.973 -0.558 . . . . 75.3 110.419 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 39' ' ' ALA . 42.9 mm -55.99 -53.15 41.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.155 -0.475 . . . . 74.04 110.817 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 88.5 m-20 -59.49 -43.7 93.26 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.471 -0.332 . . . . 74.45 110.592 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.42 -49.94 71.64 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.963 -0.562 . . . . 65.13 112.096 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.2 m-85 -61.04 -51.96 66.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.327 0.108 . . . . 75.14 110.784 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.426 HG22 ' HE2' ' A' ' 51' ' ' LYS . 69.7 mt -54.75 -43.29 66.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.829 0.347 . . . . 71.14 111.117 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 14.6 mm100 -63.81 -45.58 88.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.398 -0.365 . . . . 55.14 111.141 178.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -69.01 -36.26 77.6 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 111.842 0.312 . . . . 64.23 111.842 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 46' ' ' TYR . 83.9 mt -61.42 -49.74 83.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.291 . . . . 64.2 110.744 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HE2' HG22 ' A' ' 47' ' ' ILE . 52.0 mtmt -64.66 -34.94 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.22 111.472 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.8 m -65.51 -31.29 72.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.304 -0.407 . . . . 72.0 111.497 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.91 25.65 6.72 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.562 -0.827 . . . . 63.15 111.826 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -89.24 -75.41 0.44 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.118 0.485 . . . . 40.45 110.207 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 8.7 mm-40 -109.67 146.3 35.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.66 -0.7 . . . . 70.31 109.545 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -88.71 159.53 17.76 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 109.643 -0.503 . . . . 74.35 109.643 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -53.59 -42.01 67.17 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.639 0.257 . . . . 71.51 111.126 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.49 -12.74 61.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.386 -0.37 . . . . 74.51 111.559 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -80.01 -29.75 39.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.056 0.455 . . . . 45.13 110.313 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.2 -45.86 7.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.176 -0.465 . . . . 72.31 111.42 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.99 67.27 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.734 0.642 . . . . 72.43 112.734 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.629 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 15.0 m -88.91 -3.25 58.79 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.312 0.486 . . . . 64.54 112.312 -177.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -133.5 -47.32 0.82 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.341 0.497 . . . . 73.24 112.341 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -99.25 23.79 8.76 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.132 0.419 . . . . 71.11 112.132 -174.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -112.47 127.63 56.1 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.083 0.468 . . . . 32.11 110.375 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.492 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 8.2 m-20 -90.24 65.97 6.48 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.023 -0.535 . . . . 73.13 110.252 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.2 p -155.87 169.17 25.04 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.134 -0.485 . . . . 71.35 110.173 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.8 m -69.71 -23.71 63.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.008 0.433 . . . . 74.12 110.588 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.1 m -67.27 -15.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.901 -0.591 . . . . 70.24 111.73 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.34 -30.13 70.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.193 0.52 . . . . 71.22 110.605 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -84.09 -7.95 59.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.925 -0.579 . . . . 72.22 109.974 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.41 21.72 16.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.583 -0.735 . . . . 65.54 110.841 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.629 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 26.9 mtp180 69.45 12.93 8.36 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.996 -0.547 . . . . 74.03 111.699 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.43 -10.31 73.82 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.211 -0.755 . . . . 71.05 111.211 -177.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -71.58 129.33 38.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.815 0.34 . . . . 54.02 110.745 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 76' ' ' LEU . 4.8 tt -89.07 -35.47 16.31 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.166 -0.679 . . . . 74.44 109.166 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.77 -178.02 33.37 Favored Glycine 0 N--CA 1.432 -1.595 0 N-CA-C 110.449 -1.061 . . . . 61.34 110.449 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 112.97 11.87 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.925 0.362 . . . . 62.41 110.132 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -116.03 151.57 35.23 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.814 0.34 . . . . 71.22 111.301 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -169.53 -169.62 0.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.267 -0.642 . . . . 62.54 109.267 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 63.16 18.77 11.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.215 0.606 . . . . 74.44 112.521 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 66.0 33.75 86.43 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.863 -0.684 . . . . 72.51 112.736 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -83.24 -14.26 53.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.894 0.378 . . . . 64.13 111.027 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.5 tpp -115.64 154.27 29.78 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.991 -0.55 . . . . 73.54 109.586 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -51.45 134.49 28.73 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.466 0.479 . . . . 64.31 111.674 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.7 tptt -56.61 -47.78 98.37 Favored Pre-proline 0 CA--C 1.548 0.88 0 N-CA-C 112.809 0.67 . . . . 54.24 112.809 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.1 Cg_endo -54.74 -25.18 41.19 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.257 1.972 . . . . 74.43 111.979 177.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.472 ' CE2' HG12 ' A' ' 113' ' ' ILE . 41.3 t80 -85.84 -43.47 13.26 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.71 -0.677 . . . . 74.31 109.33 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.6 -51.64 68.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.383 -0.826 . . . . 73.45 111.31 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.47 ' OD2' ' HE3' ' A' ' 86' ' ' LYS . 8.8 m-20 -54.5 -46.57 73.49 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.535 -0.302 . . . . 71.4 111.078 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -64.68 -42.24 95.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.806 -0.634 . . . . 74.35 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -65.68 -45.2 83.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.83 0.348 . . . . 71.34 111.269 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -65.73 -24.83 67.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.158 -0.474 . . . . 73.35 111.314 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.76 -5.38 59.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.283 -0.417 . . . . 41.31 111.574 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 96.6 mt -96.69 143.68 27.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.706 0.289 . . . . 72.44 110.389 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -92.17 -179.73 5.33 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.345 -0.389 . . . . 72.42 110.245 176.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.3 m -64.79 125.12 23.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.944 -0.571 . . . . 74.41 110.324 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.29 21.55 64.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.901 -0.666 . . . . 62.33 111.999 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.434 ' HG3' HD22 ' A' ' 95' ' ' LEU . 8.3 tp10 -111.81 143.91 41.98 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.037 0.446 . . . . 72.11 110.917 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -124.79 134.83 52.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.449 -0.796 . . . . 71.43 109.773 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -80.11 -69.0 0.62 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.009 0.433 . . . . 74.11 111.02 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.428 ' O ' ' HA ' ' A' ' 112' ' ' ILE . . . 139.69 -142.82 13.07 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 111.188 -0.765 . . . . 72.11 111.188 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.461 ' HB3' HG21 ' A' ' 43' ' ' ILE . 62.8 Cg_endo -76.45 98.37 1.2 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.552 2.168 . . . . 75.24 112.933 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -95.08 110.95 24.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.237 -0.653 . . . . 64.44 109.237 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -82.51 122.94 28.7 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.126 -0.488 . . . . 75.02 111.834 -177.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.0 p -136.74 174.39 10.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.61 -0.723 . . . . 63.12 109.669 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -62.99 -31.2 72.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.932 0.396 . . . . 73.14 110.961 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.4 p -79.76 -5.65 55.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 71.51 111.793 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 123.1 -156.72 17.52 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.687 -0.768 . . . . 63.3 111.886 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 48.4 mt -97.62 126.97 50.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.588 0.233 . . . . 75.23 110.387 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.549 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 93.1 m-70 -114.34 135.44 54.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.517 -0.311 . . . . 75.34 111.204 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 45.3 mt -105.75 125.37 61.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 107.915 -1.143 . . . . 71.5 107.915 173.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ILE . . . . . 0.472 HG12 ' CE2' ' A' ' 88' ' ' PHE . 32.0 mt -107.71 128.96 62.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.791 0.329 . . . . 65.31 111.779 -176.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.5 tp -131.44 108.88 9.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.771 -0.649 . . . . 71.33 109.589 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -81.43 120.84 25.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.74 0.305 . . . . 75.32 110.68 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 p -100.05 -29.21 12.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.335 -0.393 . . . . 64.3 111.278 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 20.9 mm-40 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.485 -0.769 . . . . 52.41 110.697 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.606 0 CA-C-O 121.287 0.565 . . . . 61.329999999999998 109.653 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -127.28 117.17 21.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.345 -0.843 . . . . 73.519999999999996 109.788 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.52 137.08 57.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-N 116.327 -0.397 . . . . 72.109999999999999 110.378 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 36.6 ttt180 -112.31 125.84 54.62 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.464 -0.334 . . . . 75.519999999999996 110.183 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -143.23 139.18 30.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.0 0.429 . . . . 51.009999999999998 111.204 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 15.4 m -98.29 153.87 18.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.428 -0.953 . . . . 41.509999999999998 108.428 176.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 145.83 37.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.406 0.891 . . . . 71.120000000000005 113.406 -175.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.432 ' HG ' ' HB2' ' A' ' 65' ' ' SER . 10.4 tt -122.59 141.01 52.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.945 -1.025 . . . . 73.25 108.322 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.59 HD23 ' CD2' ' A' ' 111' ' ' HIS . 2.7 tm? -139.17 131.05 27.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.93 0.395 . . . . 70.420000000000002 110.944 -178.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.414 ' N ' HD22 ' A' ' 15' ' ' LEU . 73.4 t -123.63 126.17 72.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.786 -0.82 . . . . 75.200000000000003 108.786 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.449 ' HE2' ' HB3' ' A' ' 26' ' ' SER . 60.8 mttm -71.74 171.48 11.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.063 0.459 . . . . 63.340000000000003 111.236 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -142.31 168.72 19.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.805 -0.634 . . . . 64.430000000000007 110.117 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.6 m -56.59 -34.63 67.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.896 0.702 . . . . 64.25 112.896 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -89.84 12.64 16.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.416 0.524 . . . . 75.519999999999996 112.416 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.5 m -74.59 154.17 38.68 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 110.335 -0.246 . . . . 62.32 110.335 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.15 -42.24 99.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.962 0.411 . . . . 61.140000000000001 111.111 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -106.41 104.7 51.61 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 109.51 -0.552 . . . . 74.420000000000002 109.51 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.484 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 86.6 Cg_endo -82.93 22.39 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.886 2.391 . . . . 73.319999999999993 112.36 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 17' ' ' LYS . 25.8 p -144.44 155.72 43.87 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.699 -0.482 . . . . 72.319999999999993 109.699 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.449 ' HB3' ' HE2' ' A' ' 17' ' ' LYS . 88.9 p -136.27 -165.94 1.8 Allowed 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.773 0.32 . . . . 65.430000000000007 110.276 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -92.66 8.4 39.3 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.343 0.592 . . . . 64.340000000000003 109.868 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -134.35 -32.03 1.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.566 -0.743 . . . . 75.400000000000006 111.481 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -116.6 148.19 41.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.855 -0.424 . . . . 52.229999999999997 109.855 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -85.15 -39.81 17.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 64.310000000000002 110.74 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 25.4 pttm -143.77 134.93 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.925 -0.579 . . . . 75.109999999999999 110.527 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mm -88.63 94.08 4.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.176 -0.466 . . . . 61.020000000000003 110.143 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 m -82.54 -22.72 34.87 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.717 -0.674 . . . . 70.329999999999998 110.653 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -73.05 134.77 44.71 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.172 -0.467 . . . . 61.310000000000002 111.003 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.9 t -92.5 -171.16 2.69 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.311 -0.404 . . . . 54.210000000000001 110.23 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -52.15 -53.87 37.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.164 0.585 . . . . 62.130000000000003 111.783 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 13.7 mm-40 -64.39 -39.99 94.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.174 -0.466 . . . . 73.329999999999998 112.221 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.82 -37.9 87.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.897 0.379 . . . . 71.549999999999997 110.91 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -72.59 -35.79 67.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.107 0.48 . . . . 52.329999999999998 109.975 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 40.1 tp -62.55 -37.5 86.38 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.531 -0.759 . . . . 64.409999999999997 111.059 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 48.4 mt-10 -60.99 -42.42 98.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.447 -0.342 . . . . 72.219999999999999 110.106 178.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.3 -45.71 90.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.029 -0.532 . . . . 74.109999999999999 109.984 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.1 mm -54.45 -53.2 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.766 -0.652 . . . . 75.340000000000003 110.645 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -62.04 -35.33 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.049 -0.523 . . . . 73.439999999999998 110.99 179.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -61.33 -48.98 82.33 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.565 -0.614 . . . . 71.299999999999997 111.565 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.447 ' CD1' HD12 ' A' ' 60' ' ' LEU . 15.8 m-85 -56.61 -51.42 68.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.869 0.366 . . . . 72.140000000000001 110.113 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 78.3 mt -55.89 -48.8 77.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 115.515 -0.766 . . . . 65.310000000000002 111.316 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.78 -42.11 92.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.286 -0.416 . . . . 73.420000000000002 111.493 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 45.1 mtpt -62.97 -42.26 99.78 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.794 0.33 . . . . 73.439999999999998 111.113 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 78.9 mt -64.98 -47.94 86.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.141 -0.481 . . . . 73.019999999999996 111.024 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -64.17 -32.93 74.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.722 0.296 . . . . 74.109999999999999 111.566 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.8 m -76.23 -28.37 57.15 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.801 0.334 . . . . 74.200000000000003 111.312 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.35 13.37 28.71 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.397 -0.906 . . . . 74.319999999999993 111.933 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.64 -46.49 63.19 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.531 -0.544 . . . . 64.519999999999996 109.531 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 36.7 mt-10 -145.28 177.38 8.85 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.576 -0.738 . . . . 74.510000000000005 109.807 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -118.55 157.31 27.57 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.01 -0.737 . . . . 72.329999999999998 109.01 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -55.16 -24.74 28.13 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.331 0.493 . . . . 43.420000000000002 112.331 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -55.21 -51.0 67.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.922 0.341 . . . . 73.420000000000002 111.922 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.0 p -70.51 -39.71 73.93 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 120.906 0.384 . . . . 61.310000000000002 110.992 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.447 HD12 ' CD1' ' A' ' 46' ' ' TYR . 3.6 mm? -64.15 -46.94 81.83 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.982 -0.553 . . . . 73.219999999999999 111.336 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.504 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -72.95 -10.37 59.73 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.256 0.465 . . . . 74.430000000000007 112.256 -178.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.619 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 40.5 m -101.49 -52.25 3.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 64.329999999999998 111.793 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -102.62 -2.57 28.12 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.01 0.744 . . . . 70.140000000000001 113.01 -174.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -128.69 16.68 6.39 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 120.827 0.346 . . . . 73.409999999999997 111.05 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.432 ' HB2' ' HG ' ' A' ' 14' ' ' LEU . 23.3 t -125.27 149.89 47.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 73.400000000000006 111.063 -178.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -92.0 -14.96 28.59 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.581 -0.736 . . . . 74.319999999999993 110.306 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.1 m -55.3 134.1 49.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.751 -0.659 . . . . 74.420000000000002 111.241 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.6 m -60.02 -25.83 65.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 73.109999999999999 110.808 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 m -68.64 -6.8 28.0 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.077 -0.511 . . . . 70.230000000000004 111.602 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.73 -29.1 58.93 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.669 0.387 . . . . 42.200000000000003 111.704 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -71.43 -17.32 62.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.05 0.453 . . . . 74.510000000000005 110.898 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 73' ' ' ARG . . . -114.16 30.03 7.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.84 -0.618 . . . . 52.210000000000001 109.922 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.619 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 86.8 mtm180 74.37 10.87 4.2 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.549 -0.751 . . . . 75.049999999999997 112.406 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.504 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 86.17 2.51 85.68 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.843 -0.694 . . . . 62.450000000000003 113.126 177.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.474 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 30.4 t70 -85.23 140.72 30.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.903 0.382 . . . . 74.510000000000005 111.247 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.5 mt -94.01 -12.2 29.16 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 71.420000000000002 110.645 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 81.09 -166.32 48.22 Favored Glycine 0 N--CA 1.436 -1.351 0 N-CA-C 111.169 -0.773 . . . . 52.310000000000002 111.169 -177.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.84 109.11 17.86 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.935 0.398 . . . . 72.129999999999995 110.412 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.9 p90 -115.93 176.45 5.08 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 116.211 -0.449 . . . . 74.209999999999994 110.21 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.5 t -121.54 -172.13 2.36 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 110.05 -0.352 . . . . 74.540000000000006 110.05 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -73.8 149.33 41.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.205 -0.452 . . . . 62.409999999999997 110.255 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.96 36.19 57.46 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.792 -0.718 . . . . 23.510000000000002 111.745 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -126.8 -22.91 3.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.663 0.268 . . . . 64.120000000000005 111.534 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.434 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 46.8 tpp -131.63 164.54 25.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.736 -0.211 . . . . 74.439999999999998 110.902 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -52.32 139.63 23.83 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.585 -0.279 . . . . 42.399999999999999 110.44 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 55.8 tptt -51.57 -51.45 69.46 Favored Pre-proline 0 CA--C 1.551 1.004 0 N-CA-C 113.408 0.892 . . . . 73.409999999999997 113.408 -176.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.7 Cg_exo -56.32 -28.62 72.97 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.073 1.848 . . . . 63.119999999999997 112.741 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.588 ' CE2' HG12 ' A' ' 113' ' ' ILE . 21.4 t80 -90.25 -52.33 4.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.161 -0.472 . . . . 75.329999999999998 110.346 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.27 -49.84 76.02 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.736 -0.665 . . . . 72.519999999999996 111.439 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.75 -32.7 74.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 73.310000000000002 110.725 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.34 -37.16 71.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.042 -0.526 . . . . 62.210000000000001 110.142 178.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.458 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 40.3 m -59.01 -45.19 91.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.276 -0.42 . . . . 73.219999999999999 110.595 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -69.82 -28.31 65.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.394 -0.366 . . . . 65.409999999999997 111.026 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.81 -30.91 59.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 62.450000000000003 111.073 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 89.8 mt -72.2 168.03 19.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.19 -0.459 . . . . 71.340000000000003 110.466 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -104.06 173.52 6.27 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.313 -0.403 . . . . 73.319999999999993 109.972 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.1 m -69.51 116.21 9.66 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.879 -0.415 . . . . 51.340000000000003 109.879 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.51 45.96 5.36 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.888 -0.885 . . . . 51.149999999999999 110.888 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.41 130.86 52.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.698 0.285 . . . . 65.25 110.768 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.2 ttp -109.3 108.28 18.81 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.114 -0.494 . . . . 71.340000000000003 109.754 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.451 ' HB2' HD11 ' A' ' 95' ' ' LEU . 47.7 t -73.25 155.9 39.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.777 -0.647 . . . . 62.030000000000001 110.653 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.42 -154.64 15.03 Favored Glycine 0 N--CA 1.435 -1.41 0 CA-C-N 115.775 -0.648 . . . . 53.240000000000002 112.231 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.79 104.57 0.69 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.054 2.503 . . . . 71.439999999999998 113.053 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.9 t -101.78 117.65 47.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 51.200000000000003 109.688 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.13 124.14 28.99 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.902 0.382 . . . . 72.230000000000004 110.996 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -135.0 -173.72 3.39 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 116.193 -0.458 . . . . 72.140000000000001 109.927 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 106' ' ' THR . 4.6 m-20 -49.61 -61.9 1.85 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.713 0.805 . . . . 72.450000000000003 112.699 -177.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.5 p -64.8 -37.23 86.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.459 0.54 . . . . 74.5 112.459 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 163.06 -139.19 5.75 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.635 -0.793 . . . . 72.299999999999997 112.009 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.5 mt -91.21 129.18 42.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 120.776 0.322 . . . . 71.040000000000006 110.145 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.59 ' CD2' HD23 ' A' ' 15' ' ' LEU . 10.7 m170 -116.69 143.81 45.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.106 -0.497 . . . . 72.349999999999994 110.996 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 52.2 mt -110.73 126.16 68.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 108.138 -1.06 . . . . 75.209999999999994 108.138 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.588 HG12 ' CE2' ' A' ' 88' ' ' PHE . 20.2 mt -108.18 116.44 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.65 0.262 . . . . 71.439999999999998 111.295 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.7 tp -113.5 101.65 9.55 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 110.018 -0.364 . . . . 74.319999999999993 110.018 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 92' ' ' SER . 75.0 ttt180 -84.7 106.78 16.51 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.669 -0.412 . . . . 75.230000000000004 109.976 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.1 p -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.065 -0.516 . . . . 74.340000000000003 110.719 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.359 -0.829 . . . . 64.230000000000004 110.322 179.851 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.393 0 CA-C-O 121.053 0.454 . . . . 72.129999999999995 110.295 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HG2' ' HB1' ' A' ' 78' ' ' ALA . 74.9 ttt180 -111.75 111.32 22.21 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.562 -0.903 . . . . 74.439999999999998 108.562 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.93 160.74 8.77 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-O 121.133 0.492 . . . . 62.200000000000003 111.796 -174.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.556 ' HB3' ' CG ' ' A' ' 117' ' ' GLU . 67.0 ttt180 -133.27 122.57 24.1 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 109.236 -0.653 . . . . 74.519999999999996 109.236 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -134.78 145.41 48.37 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.074 0.464 . . . . 72.340000000000003 111.336 -177.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -99.89 140.95 33.36 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.231 -1.026 . . . . 73.510000000000005 108.231 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.526 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 9.4 p80 -125.4 133.33 52.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.935 0.717 . . . . 74.409999999999997 112.935 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.477 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 6.5 tt -112.84 124.04 51.68 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.349 -1.352 . . . . 54.43 107.349 174.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HB3' ' HB2' ' A' ' 67' ' ' SER . 39.9 tp -108.89 127.77 54.33 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 112.23 0.455 . . . . 51.43 112.23 -177.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.3 p -118.03 114.0 43.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.354 -0.839 . . . . 52.350000000000001 108.943 174.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -85.16 175.62 8.86 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.031 -0.531 . . . . 63.399999999999999 111.166 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -145.15 165.59 27.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.108 -0.496 . . . . 73.129999999999995 110.701 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 32' ' ' ILE . 33.3 t -54.93 -52.21 63.68 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.682 0.614 . . . . 71.319999999999993 112.281 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -84.03 38.22 0.64 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.211 0.449 . . . . 52.409999999999997 112.211 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.4 t -91.54 162.63 14.45 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.973 -0.38 . . . . 73.409999999999997 109.973 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -12.52 60.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.228 0.537 . . . . 74.420000000000002 110.446 177.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -149.69 83.1 6.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.499 -0.773 . . . . 72.439999999999998 109.056 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -81.46 25.57 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.389 2.726 . . . . 53.140000000000001 112.576 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.0 p -122.9 138.9 54.53 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.522 -0.308 . . . . 65.019999999999996 110.67 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -136.11 -167.08 1.98 Allowed 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.421 -0.354 . . . . 75.319999999999993 110.285 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 68.6 p-90 -83.75 -19.51 35.01 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.257 -0.428 . . . . 74.230000000000004 110.429 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -102.73 -43.55 5.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.984 -0.553 . . . . 50.409999999999997 110.97 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -124.07 115.52 21.3 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.3 -0.63 . . . . 72.209999999999994 109.3 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -67.93 -31.2 70.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.393 -0.367 . . . . 74.040000000000006 110.605 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 20.6 ptmt -134.86 105.99 6.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.268 0.556 . . . . 75.209999999999994 111.02 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 19' ' ' SER . 28.4 mm -71.73 122.32 23.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.662 -0.699 . . . . 72.099999999999994 109.281 177.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.6 p -104.75 -17.85 14.47 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.426 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -65.36 141.8 58.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.845 0.355 . . . . 73.209999999999994 110.327 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.9 t -97.59 -179.15 4.37 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.448 -0.342 . . . . 64.109999999999999 110.995 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -56.65 -47.64 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.911 -0.586 . . . . 62.32 111.464 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 10.8 mm-40 -59.18 -45.47 90.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.029 -0.532 . . . . 64.430000000000007 111.097 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.65 -38.84 92.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 54.210000000000001 110.505 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.12 -40.8 90.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 71.540000000000006 110.722 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.39 -38.98 89.01 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.244 -0.435 . . . . 71.329999999999998 110.433 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 49.2 mt-10 -63.54 -35.47 80.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 74.430000000000007 110.252 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.8 mt -70.02 -41.36 74.41 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.752 -0.658 . . . . 74.420000000000002 109.946 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.5 mm -53.51 -55.79 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.963 -0.562 . . . . 54.229999999999997 110.15 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.592 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.6 m-20 -57.26 -40.06 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.623 -0.717 . . . . 73.209999999999994 110.716 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.46 -46.83 93.28 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.98 -0.555 . . . . 71.109999999999999 112.181 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -60.62 -44.73 96.0 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.062 0.458 . . . . 74.140000000000001 109.909 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 43' ' ' ILE . 70.1 mt -56.88 -45.94 83.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-N 115.529 -0.76 . . . . 71.340000000000003 111.075 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 66.1 mm-40 -60.6 -44.76 95.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 72.310000000000002 110.979 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.471 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 66.4 mttm -62.18 -40.96 97.79 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.066 -0.516 . . . . 54.229999999999997 111.63 -177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.5 mt -72.27 -47.82 51.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.184 -0.462 . . . . 63.039999999999999 111.475 -178.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.49 -26.6 65.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.526 0.565 . . . . 73.25 112.526 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -85.07 -1.19 56.56 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.879 0.371 . . . . 72.120000000000005 111.274 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.44 75.43 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.788 -0.72 . . . . 31.149999999999999 112.417 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -84.54 -54.98 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.449 -0.575 . . . . 73.329999999999998 109.449 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.471 ' OE2' ' HD3' ' A' ' 49' ' ' LYS . 43.3 mt-10 -133.37 176.48 8.49 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.23 -0.895 . . . . 74.239999999999995 109.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.494 ' O ' HD13 ' A' ' 60' ' ' LEU . 3.1 p30 -122.77 165.26 16.87 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.244 0.545 . . . . 75.109999999999999 111.683 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.5 t80 -61.84 -43.72 98.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.176 -0.92 . . . . 75.519999999999996 111.82 -176.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 73' ' ' ARG . 45.6 mt-10 -64.29 -42.83 96.22 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.282 0.475 . . . . 72.209999999999994 112.282 -176.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.9 t -66.58 -34.93 79.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.136 0.494 . . . . 72.140000000000001 110.191 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' ASP . 10.5 mp -77.84 -29.69 50.63 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.894 -0.594 . . . . 73.319999999999993 111.11 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.96 -49.2 77.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.774 0.321 . . . . 74.450000000000003 111.281 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.545 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 26.4 m -75.13 12.04 1.0 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.431 0.53 . . . . 45.509999999999998 112.431 -178.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -133.77 -57.51 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.398 . . . . 74.319999999999993 111.731 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -93.61 21.27 6.49 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.925 -0.579 . . . . 73.030000000000001 112.439 -174.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.3 t -118.09 142.43 47.42 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.347 -0.541 . . . . 54.409999999999997 110.468 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -97.54 12.57 32.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.891 -0.595 . . . . 74.030000000000001 110.473 -178.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 36.1 t -98.38 144.4 27.8 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.211 -0.449 . . . . 51.409999999999997 110.807 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.1 m -71.14 -16.25 62.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 74.25 110.177 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -73.33 -6.78 48.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.019 -0.537 . . . . 70.450000000000003 110.693 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.545 ' HB1' ' HA ' ' A' ' 62' ' ' SER . . . -67.09 -25.17 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.961 -0.563 . . . . 60.32 109.897 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -64.57 -35.04 79.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.343 -0.844 . . . . 75.219999999999999 109.488 177.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.0 19.08 3.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.538 -0.756 . . . . 70.230000000000004 110.894 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 58' ' ' GLU . 18.9 mtp180 69.61 8.07 6.55 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.273 0.629 . . . . 72.349999999999994 111.785 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.19 -9.75 68.72 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.929 -0.653 . . . . 61.340000000000003 113.085 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.1 123.93 30.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.017 0.436 . . . . 62.140000000000001 111.535 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.3 mt -90.54 -25.38 20.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.677 -0.692 . . . . 73.230000000000004 111.028 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.52 -169.54 16.34 Favored Glycine 0 N--CA 1.434 -1.463 0 N-CA-C 111.072 -0.811 . . . . 45.140000000000001 111.072 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 8' ' ' ARG . . . -86.57 109.91 19.45 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.077 0.465 . . . . 74.430000000000007 111.197 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -118.25 177.13 4.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.922 -0.581 . . . . 72.319999999999993 110.118 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.4 t -141.41 176.49 8.82 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.864 -0.421 . . . . 64.450000000000003 109.864 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.618 ' HD2' ' O ' ' A' ' 81' ' ' ARG . 6.9 ppt_? -60.42 128.79 38.42 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.37 0.605 . . . . 72.310000000000002 111.733 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 111.82 12.0 15.43 Favored Glycine 0 N--CA 1.437 -1.278 0 CA-C-N 115.317 -0.856 . . . . 72.150000000000006 111.354 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.97 -33.33 3.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.885 0.374 . . . . 74.430000000000007 110.907 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.464 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 44.1 tpp -112.62 165.31 12.38 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.827 0.346 . . . . 61.020000000000003 111.447 -176.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -74.57 148.49 40.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 61.229999999999997 110.052 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.2 tptt -40.69 -55.45 4.49 Favored Pre-proline 0 N--CA 1.484 1.248 0 N-CA-C 114.559 1.318 . . . . 74.349999999999994 114.559 -175.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 14.8 Cg_endo -55.77 -29.02 69.86 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.731 2.287 . . . . 50.439999999999998 113.787 -176.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.503 ' CE2' HG12 ' A' ' 113' ' ' ILE . 10.3 t80 -100.53 -39.76 7.76 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.062 0.458 . . . . 62.399999999999999 110.092 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.86 -64.28 0.96 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 75.319999999999993 111.414 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.35 -35.41 77.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.847 -0.615 . . . . 73.230000000000004 111.391 -176.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -65.41 -33.34 75.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 73.450000000000003 111.237 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 71.9 m -64.4 -28.48 69.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.012 0.434 . . . . 74.099999999999994 111.536 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.86 -7.27 57.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 75.140000000000001 110.569 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.72 -3.59 23.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.979 -0.555 . . . . 74.510000000000005 111.466 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.5 mt -99.96 135.97 40.58 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 74.319999999999993 111.137 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -98.15 166.53 11.37 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.787 -0.642 . . . . 74.409999999999997 110.382 178.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -57.28 123.25 14.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.878 0.371 . . . . 72.209999999999994 111.487 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.5 -6.99 77.96 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.76 -0.733 . . . . 72.109999999999999 112.28 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -93.24 143.92 25.8 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.989 -0.374 . . . . 73.099999999999994 109.989 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.7 ttp -135.08 136.16 41.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.202 -0.454 . . . . 73.25 110.935 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -99.6 123.0 43.45 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.962 -0.755 . . . . 71.420000000000002 108.962 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.35 -76.31 1.31 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.698 -0.763 . . . . 60.310000000000002 113.937 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.68 83.9 1.29 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.716 2.277 . . . . 74.239999999999995 113.862 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 111' ' ' HIS . 90.1 t -116.6 102.85 14.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.155 -0.683 . . . . 53.439999999999998 109.155 175.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -83.59 122.69 28.92 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.131 0.491 . . . . 72.549999999999997 111.667 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.542 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -131.61 -168.49 2.03 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.857 -0.794 . . . . 73.430000000000007 108.857 178.338 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.542 ' H ' HG22 ' A' ' 106' ' ' THR . 5.5 m-20 -55.0 -56.08 23.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.449 0.537 . . . . 62.229999999999997 112.449 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.3 p -71.44 -30.63 66.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.775 0.657 . . . . 71.450000000000003 112.775 -177.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -138.33 6.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.311 -0.947 . . . . 62.43 111.892 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 49.3 mt -91.7 127.67 43.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 120.929 0.395 . . . . 71.209999999999994 110.528 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.518 ' O ' ' HB ' ' A' ' 104' ' ' VAL . 13.5 m-70 -110.56 128.96 55.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.894 -0.593 . . . . 73.409999999999997 109.886 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.6 mt -99.38 123.51 52.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.895 -0.779 . . . . 72.430000000000007 108.895 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.503 HG12 ' CE2' ' A' ' 88' ' ' PHE . 14.8 mt -107.37 113.9 44.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.138 -0.483 . . . . 73.25 110.982 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 54.0 tp -104.55 123.81 48.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.554 -0.294 . . . . 74.439999999999998 110.54 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 8.5 tpt180 -87.58 99.16 11.84 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.833 -0.432 . . . . 70.209999999999994 109.833 177.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.5 p -80.87 -46.09 15.81 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.968 -0.56 . . . . 51.530000000000001 111.699 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.556 ' CG ' ' HB3' ' A' ' 10' ' ' ARG . 70.8 mm-40 . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.695 -0.669 . . . . 75.439999999999998 111.045 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.747 0.308 . . . . 71.549999999999997 110.479 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -106.98 142.14 37.07 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.657 -0.497 . . . . 73.109999999999999 109.657 177.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.552 HG12 ' NH1' ' A' ' 115' ' ' ARG . 25.9 m -139.38 129.46 31.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 120.878 0.37 . . . . 71.439999999999998 111.384 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 0.7 OUTLIER -100.24 107.38 19.2 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 107.806 -1.183 . . . . 75.040000000000006 107.806 171.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.3 m -133.32 144.7 49.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.806 -0.634 . . . . 74.510000000000005 111.367 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -103.52 155.8 18.25 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.536 -0.913 . . . . 73.150000000000006 108.536 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.507 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.2 p80 -137.68 141.57 41.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.861 0.689 . . . . 74.209999999999994 112.861 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 15' ' ' LEU . 7.4 tt -115.44 143.23 45.6 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.796 -1.187 . . . . 74.239999999999995 107.796 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.531 HD13 ' CE1' ' A' ' 111' ' ' HIS . 40.7 tp -126.8 124.65 40.16 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.998 0.427 . . . . 74.25 111.9 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.1 t -112.81 118.39 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 115.445 -0.798 . . . . 74.340000000000003 109.056 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -86.5 -173.99 4.79 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.5 0.667 . . . . 74.420000000000002 111.284 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -160.65 172.96 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.062 -0.972 . . . . 72.329999999999998 108.498 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.7 m -54.05 -42.52 69.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.922 0.342 . . . . 64.200000000000003 111.922 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -88.43 54.95 3.22 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 75.209999999999994 111.597 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 t -108.03 170.07 8.23 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.827 -0.434 . . . . 73.310000000000002 109.827 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.517 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -73.28 -30.3 63.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.358 0.599 . . . . 71.109999999999999 109.923 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -134.81 94.81 16.17 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.555 -0.748 . . . . 75.109999999999999 109.45 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 85.6 Cg_endo -80.01 33.69 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 74.430000000000007 112.263 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -143.66 126.57 16.27 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.937 -0.574 . . . . 52.210000000000001 109.741 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.3 m -135.6 175.64 9.41 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.398 -0.364 . . . . 72.019999999999996 110.627 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -73.28 -14.0 61.23 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 111.203 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -91.15 -44.24 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 71.019999999999996 110.548 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -136.31 134.45 37.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.928 -0.578 . . . . 65.209999999999994 110.192 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.43 -47.84 83.94 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.091 -0.504 . . . . 74.120000000000005 111.069 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 60.7 pttt -126.66 113.43 16.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.051 0.453 . . . . 70.400000000000006 110.485 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.45 104.14 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.703 -0.681 . . . . 74.209999999999994 110.199 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.5 m -114.63 96.44 5.75 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 116.017 -0.538 . . . . 73.209999999999994 110.221 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -167.47 134.35 2.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.822 -0.626 . . . . 65.400000000000006 110.09 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 t -74.99 174.74 8.9 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.735 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -58.05 -38.18 75.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.824 0.345 . . . . 74.540000000000006 110.577 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.7 mt-10 -58.02 -46.39 85.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.784 -0.644 . . . . 74.109999999999999 110.772 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 74.5 mm-40 -59.96 -43.46 95.04 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.140000000000001 111.104 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -64.25 -42.12 96.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.02 -0.536 . . . . 74.319999999999993 110.254 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.7 tp -63.73 -43.76 95.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.671 -0.695 . . . . 63.140000000000001 110.667 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 64.6 mm-40 -59.95 -43.03 95.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.08 -0.509 . . . . 73.519999999999996 110.754 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 83.9 mt -63.89 -48.71 75.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.331 -0.395 . . . . 75.040000000000006 110.664 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 39' ' ' ALA . 30.6 mm -55.49 -56.98 9.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.076 -0.511 . . . . 63.030000000000001 111.053 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 39.7 m-80 -60.07 -35.95 76.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.266 -0.425 . . . . 71.239999999999995 110.892 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.31 -49.48 75.73 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.768 -0.651 . . . . 24.420000000000002 111.979 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.423 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 26.6 m-85 -61.24 -47.1 87.62 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.978 -0.378 . . . . 74.319999999999993 109.978 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.7 mt -51.12 -51.48 21.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.73 -0.668 . . . . 63.32 111.21 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 68.4 mm-40 -63.18 -40.11 96.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.485 -0.325 . . . . 73.329999999999998 111.149 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -62.39 -47.14 85.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.945 0.402 . . . . 63.43 110.957 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.77 -46.02 83.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.914 -0.584 . . . . 75.120000000000005 111.369 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -64.45 -38.55 91.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.431 -0.349 . . . . 51.210000000000001 111.527 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.1 t -70.62 -20.86 62.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.9 0.381 . . . . 64.310000000000002 110.836 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 94.3 18.4 36.41 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.68 -0.771 . . . . 63.32 112.452 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.2 -66.46 0.54 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.184 0.516 . . . . 71.129999999999995 111.053 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -137.38 161.88 35.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.518 -0.765 . . . . 73.439999999999998 110.692 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -78.7 144.87 34.9 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.048 -0.524 . . . . 71.450000000000003 112.089 -177.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.04 -41.73 94.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.662 -0.699 . . . . 74.519999999999996 110.055 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -59.83 -33.26 71.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.813 -0.631 . . . . 75.420000000000002 110.755 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.9 t -77.89 -34.52 51.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.985 -0.552 . . . . 72.209999999999994 110.619 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 99.1 mt -76.71 -40.85 47.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.475 -0.33 . . . . 75.439999999999998 111.157 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.58 -16.44 63.86 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.252 0.464 . . . . 75.340000000000003 112.252 -177.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.5 p -95.08 -4.65 45.95 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.739 0.304 . . . . 65.129999999999995 111.447 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -126.01 -58.68 1.37 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 120.872 0.368 . . . . 70.340000000000003 111.909 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.423 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 88.5 m-85 -93.94 38.4 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.257 -0.429 . . . . 71.310000000000002 112.058 -174.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -121.63 128.62 52.11 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.198 -0.668 . . . . 65.340000000000003 109.198 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -69.37 -28.72 66.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.089 0.471 . . . . 74.25 110.755 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 p -61.83 143.98 55.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 51.130000000000003 111.295 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.2 m -74.56 -8.55 56.7 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.195 0.522 . . . . 73.420000000000002 110.742 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.7 m -70.46 -4.47 22.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 54.32 111.058 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.53 -32.57 51.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.018 -0.537 . . . . 72.409999999999997 111.889 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -66.24 -33.28 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 72.530000000000001 110.74 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.62 7.48 36.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.64 -0.504 . . . . 61.43 109.64 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? 64.92 18.37 11.46 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.342 -0.844 . . . . 74.400000000000006 110.87 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 67.76 19.88 71.75 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.719 -0.673 . . . . 50.32 112.577 -179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.74 139.05 31.06 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.872 0.336 . . . . 63.219999999999999 111.14 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.0 mt -115.21 2.38 14.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.171 -0.468 . . . . 73.239999999999995 110.766 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.573 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 71.63 -154.94 51.84 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.36 -0.924 . . . . 72.329999999999998 111.062 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -91.87 108.39 19.89 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.859 0.362 . . . . 70.230000000000004 110.299 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.42 171.93 7.53 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.156 -0.474 . . . . 63.229999999999997 110.675 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.2 t -160.7 171.66 18.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.826 0.346 . . . . 71.450000000000003 111.43 -177.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 64.48 -82.38 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.31 1.044 . . . . 73.340000000000003 112.91 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -174.43 86.68 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.581 -0.819 . . . . 21.350000000000001 112.134 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -102.07 -24.07 14.0 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.483 -0.562 . . . . 54.399999999999999 109.483 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . 0.424 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 35.8 tpp -113.86 172.12 7.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.54 -0.754 . . . . 71.25 109.517 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.96 141.56 33.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.45 0.167 . . . . 72.25 111.221 178.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.447 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.5 tptm -50.32 -50.5 70.46 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 113.645 0.98 . . . . 64.530000000000001 113.645 -176.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.447 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 77.0 Cg_exo -52.52 -35.32 66.18 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 121.993 1.796 . . . . 71.319999999999993 112.262 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 38.1 t80 -82.11 -50.14 9.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.746 -0.661 . . . . 73.010000000000005 110.308 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.493 ' HG2' ' HA2' ' A' ' 82' ' ' GLY . 2.5 tp10 -61.25 -30.04 70.21 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.857 -0.61 . . . . 71.099999999999994 111.036 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.6 -29.68 70.2 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.756 -0.657 . . . . 75.150000000000006 110.376 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.57 -24.48 21.71 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.771 -0.65 . . . . 61.340000000000003 110.922 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 m -58.82 -41.18 86.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.987 0.422 . . . . 64.439999999999998 111.077 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -91.24 12.84 18.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 65.019999999999996 111.179 -178.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.47 -26.56 26.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.726 0.298 . . . . 72.230000000000004 111.26 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.428 HD22 ' H ' ' A' ' 95' ' ' LEU . 1.4 mm? -79.35 127.77 32.5 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.255 -0.429 . . . . 75.150000000000006 110.497 -178.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -86.01 -67.21 0.83 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.267 -0.424 . . . . 75.439999999999998 111.145 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 65.3 m -138.67 108.06 6.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.61 -0.268 . . . . 73.120000000000005 111.34 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.562 ' HA2' ' O ' ' A' ' 115' ' ' ARG . . . 51.56 44.5 53.87 Favored Glycine 0 C--N 1.332 0.337 0 CA-C-N 115.926 -0.579 . . . . 72.549999999999997 113.163 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -106.77 161.48 14.63 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 122.692 -0.299 . . . . 70.109999999999999 110.745 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.4 ttp -124.7 135.6 53.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.201 -0.454 . . . . 54.5 110.239 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.8 t -89.79 151.39 21.82 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.613 -0.514 . . . . 74.329999999999998 109.613 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.54 -144.92 4.59 Favored Glycine 0 N--CA 1.44 -1.04 0 C-N-CA 121.011 -0.614 . . . . 34.43 112.756 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.87 103.36 1.0 Allowed 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.67 2.247 . . . . 73.299999999999997 113.184 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -92.89 109.58 21.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.054 -0.521 . . . . 71.450000000000003 109.669 177.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -82.28 127.89 33.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.283 -0.417 . . . . 75.230000000000004 111.457 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 38.8 p -138.08 -166.16 1.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.806 -0.634 . . . . 61.539999999999999 110.165 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -70.43 -47.3 61.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.791 0.329 . . . . 72.099999999999994 111.33 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -69.45 -37.77 77.5 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.227 -0.442 . . . . 31.329999999999998 111.377 -177.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.93 -138.95 5.68 Favored Glycine 0 N--CA 1.441 -0.993 0 C-N-CA 120.766 -0.73 . . . . 70.040000000000006 111.696 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.5 mt -108.4 135.9 45.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 110.107 -0.331 . . . . 71.340000000000003 110.107 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.531 ' CE1' HD13 ' A' ' 15' ' ' LEU . 39.7 m-70 -120.4 152.59 37.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.717 0.294 . . . . 74.230000000000004 110.784 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 62.9 mt -115.46 128.3 72.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.004 -1.11 . . . . 72.010000000000005 108.004 173.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.8 mt -116.24 123.08 71.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.542 0.21 . . . . 72.010000000000005 111.112 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.0 tp -120.45 120.96 37.43 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.619 -0.264 . . . . 61.409999999999997 111.07 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.562 ' O ' ' HA2' ' A' ' 98' ' ' GLY . 18.8 ttt180 -89.08 119.36 29.52 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.576 -0.898 . . . . 71.530000000000001 108.576 175.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 m -85.82 -12.9 49.67 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 120.852 0.358 . . . . 75.310000000000002 111.344 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 39.2 mt-10 . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.58 -0.724 . . . . 74.239999999999995 110.858 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.811 0.339 . . . . 72.219999999999999 111.228 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -117.59 121.95 42.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.302 -0.408 . . . . 65.5 110.559 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.5 m -136.23 150.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 116.247 -0.433 . . . . 64.040000000000006 110.714 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 74.3 ttt180 -110.44 114.71 28.35 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.914 -0.773 . . . . 62.539999999999999 108.914 176.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m -129.01 152.55 48.5 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.25 0.548 . . . . 72.299999999999997 111.677 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -104.71 149.93 25.17 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.245 -1.02 . . . . 75.329999999999998 108.245 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -139.81 149.29 43.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.706 0.632 . . . . 71.129999999999995 112.706 -176.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HA ' ' OG ' ' A' ' 65' ' ' SER . 8.8 tt -118.49 131.43 56.25 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.361 -0.977 . . . . 73.150000000000006 108.361 175.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.627 ' O ' ' HA ' ' A' ' 65' ' ' SER . 2.6 tm? -123.69 112.12 17.0 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.847 0.356 . . . . 71.219999999999999 110.535 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.409 HG11 HD11 ' A' ' 43' ' ' ILE . 9.3 p -109.99 122.23 64.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.429 0.633 . . . . 70.549999999999997 110.605 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -85.03 177.46 7.92 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.597 -0.729 . . . . 75.230000000000004 110.922 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.32 173.85 15.07 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.015 -0.539 . . . . 71.450000000000003 110.371 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.1 p -56.64 -53.59 55.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.258 0.466 . . . . 74.5 112.258 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -89.83 47.16 1.43 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.12 0.486 . . . . 73.5 110.696 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.2 t -92.3 173.91 7.57 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.977 -0.556 . . . . 42.530000000000001 110.419 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.46 ' HD2' ' OD1' ' A' ' 107' ' ' ASP . 46.6 ttt180 -68.89 -22.38 64.19 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.494 -0.928 . . . . 70.329999999999998 108.494 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.2 tpp180 -150.46 98.61 3.24 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 114.562 -1.199 . . . . 71.420000000000002 108.746 176.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.412 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 71.8 Cg_endo -76.14 26.07 0.42 Allowed 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.214 2.609 . . . . 73.109999999999999 112.971 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.9 m -130.92 147.39 52.56 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.986 -0.552 . . . . 72.310000000000002 109.565 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.4 p -134.31 -178.42 5.04 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.88 0.371 . . . . 72.409999999999997 110.337 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 66' ' ' ASP . 44.4 p-90 -81.53 -0.78 43.57 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.587 -0.523 . . . . 75.319999999999993 109.587 175.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -102.36 -52.55 3.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.565 -0.743 . . . . 73.25 110.261 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -132.65 165.23 24.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.340000000000003 111.462 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.69 -38.91 28.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.034 -0.53 . . . . 53.119999999999997 111.184 -177.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 17.9 ptmt -135.67 125.58 25.79 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 120.936 0.398 . . . . 54.310000000000002 111.172 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.15 122.07 34.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.992 -0.549 . . . . 75.140000000000001 109.811 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.0 m -86.84 -40.44 14.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.579 0.228 . . . . 74.540000000000006 111.104 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -63.33 125.87 25.57 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.364 0.602 . . . . 75.329999999999998 111.804 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.421 HG22 ' HG2' ' A' ' 38' ' ' GLU . 9.6 t -81.85 171.25 14.71 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.737 -0.665 . . . . 73.519999999999996 109.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -58.82 -33.48 70.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.887 0.375 . . . . 74.329999999999998 110.575 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.43 -41.97 98.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.91 -0.586 . . . . 75.450000000000003 110.807 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.421 ' HG2' HG22 ' A' ' 35' ' ' THR . 43.8 mm-40 -71.25 -39.74 71.45 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.966 -0.561 . . . . 71.319999999999993 110.466 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.492 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.39 -40.22 96.63 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.669 -0.696 . . . . 71.430000000000007 110.823 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.87 -43.76 77.44 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.144 -0.48 . . . . 73.25 111.603 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -58.45 -45.96 87.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.166 0.507 . . . . 62.299999999999997 110.287 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.77 -46.56 74.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.5 -0.773 . . . . 64.299999999999997 110.563 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.2 mm -56.55 -53.67 38.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.896 -0.593 . . . . 70.030000000000001 111.283 -179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.41 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 86.8 m-20 -54.72 -45.27 74.03 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 120.976 0.417 . . . . 75.140000000000001 110.664 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.73 -54.14 40.1 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.461 -0.791 . . . . 73.219999999999999 112.52 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 50' ' ' ILE . 28.5 m-85 -57.36 -46.1 83.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 111.71 0.263 . . . . 62.539999999999999 111.71 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.4 mt -55.17 -42.13 63.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 121.053 0.454 . . . . 75.209999999999994 110.871 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.3 mm-40 -74.34 -37.76 63.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.18 -0.464 . . . . 71.299999999999997 111.194 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 93.5 mttt -66.84 -33.78 76.37 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.472 -0.331 . . . . 73.230000000000004 111.131 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.602 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 89.5 mt -63.55 -43.07 98.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.966 0.412 . . . . 73.010000000000005 110.135 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -76.07 -1.67 27.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.068 -0.515 . . . . 75.109999999999999 111.139 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.4 t -103.24 -1.96 28.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.101 -0.5 . . . . 74.310000000000002 110.118 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.48 2.38 90.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.996 -0.621 . . . . 74.140000000000001 113.06 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -68.56 -65.49 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.993 0.425 . . . . 52.340000000000003 110.554 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.602 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 61.3 mm-40 -119.64 151.53 38.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.887 -0.597 . . . . 74.349999999999994 110.139 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -97.6 152.87 18.61 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.355 -0.609 . . . . 54.539999999999999 109.355 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -53.8 -40.09 66.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.527 -0.306 . . . . 75.430000000000007 111.711 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -65.85 -19.34 65.84 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 73.030000000000001 111.621 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 t -75.44 -38.0 59.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.108 0.48 . . . . 54.539999999999999 110.444 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.15 -40.64 13.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.122 -0.49 . . . . 63.450000000000003 111.112 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.67 -32.12 68.82 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.131 0.419 . . . . 62.210000000000001 112.131 -177.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 28.6 p -82.66 -14.39 54.76 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.248 0.462 . . . . 54.340000000000003 112.248 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -124.12 18.23 9.18 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.324 0.49 . . . . 74.530000000000001 112.324 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -139.31 -42.06 0.46 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 111.801 0.297 . . . . 64.510000000000005 111.801 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.6 m -64.57 132.09 48.86 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.176 0.512 . . . . 74.340000000000003 112.365 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.499 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . 20.8 t70 -84.6 -22.46 29.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.791 -0.641 . . . . 74.430000000000007 109.444 174.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -59.34 151.44 23.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.218 -0.901 . . . . 73.340000000000003 110.984 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.2 m -61.25 -13.12 16.29 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.278 0.473 . . . . 51.409999999999997 112.278 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 m -76.87 -6.19 51.41 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.592 -0.276 . . . . 70.349999999999994 111.186 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.412 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -55.93 -54.78 40.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.912 0.387 . . . . 72.010000000000005 111.337 -178.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -71.69 -8.41 53.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.161 -0.472 . . . . 74.109999999999999 110.941 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.78 13.75 32.63 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.913 -0.585 . . . . 42.039999999999999 110.174 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 69.91 15.71 7.8 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.267 -0.879 . . . . 71.120000000000005 112.57 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.77 -22.17 41.64 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.124 -0.56 . . . . 72.409999999999997 113.031 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.24 131.38 49.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.718 0.636 . . . . 74.530000000000001 112.718 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.41 -18.39 16.75 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 72.420000000000002 111.04 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.61 -175.43 40.56 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 110.898 -0.881 . . . . 51.539999999999999 110.898 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.79 122.53 24.2 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.904 0.352 . . . . 63.329999999999998 110.732 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -133.91 179.2 6.39 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.341 -0.39 . . . . 64.420000000000002 110.399 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -133.21 175.82 9.05 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 120.749 0.309 . . . . 61.039999999999999 110.317 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -78.78 156.38 28.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 74.140000000000001 111.391 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.402 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 86.01 28.38 28.67 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 116.051 -0.522 . . . . 74.540000000000006 111.961 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -127.91 -51.8 1.33 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.748 0.277 . . . . 75.109999999999999 111.748 -178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -91.91 175.61 6.82 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.749 0.309 . . . . 45.32 110.793 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -65.28 139.33 58.6 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.762 -0.459 . . . . 73.310000000000002 109.762 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.0 tptm -51.37 -52.06 63.07 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 113.456 0.91 . . . . 62.340000000000003 113.456 -175.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.6 Cg_endo -53.57 -27.33 40.73 Favored 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.419 2.079 . . . . 64.209999999999994 112.906 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -93.28 -50.86 5.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.089 0.471 . . . . 71.409999999999997 110.56 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.402 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 35.2 tt0 -61.94 -46.24 90.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.64 -0.709 . . . . 64.519999999999996 111.324 -177.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.29 -40.14 89.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.081 -0.509 . . . . 73.450000000000003 110.608 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -68.29 -31.97 71.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.874 -0.603 . . . . 74.120000000000005 110.804 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 m -68.65 -46.09 70.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.12 -0.491 . . . . 72.540000000000006 110.853 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -77.18 -10.23 59.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 74.25 111.619 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.23 8.51 32.74 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.116 0.484 . . . . 63.329999999999998 110.496 178.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 79.3 mt -101.57 131.75 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.857 -0.61 . . . . 64.340000000000003 110.581 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.5 mtm180 -76.87 172.75 12.63 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.269 -0.423 . . . . 71.439999999999998 110.106 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.0 m -55.42 111.88 0.98 Allowed 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.033 0.444 . . . . 74.319999999999993 111.868 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.32 49.77 11.42 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.801 -0.636 . . . . 61.350000000000001 112.765 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -129.19 156.26 44.22 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.878 0.371 . . . . 62.130000000000003 110.995 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.1 ttp -118.3 136.12 53.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.887 -0.597 . . . . 70.5 110.759 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.3 t -83.67 159.54 21.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.017 -0.538 . . . . 65.439999999999998 110.902 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.0 -171.09 44.28 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 111.33 -0.708 . . . . 32.25 111.33 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -65.44 107.01 0.93 Allowed 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.872 2.381 . . . . 72.219999999999999 112.774 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 91.1 t -89.68 120.56 38.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.63 -0.507 . . . . 55.240000000000002 109.63 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -95.85 133.37 40.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.057 0.456 . . . . 71.010000000000005 111.226 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 33.9 p -142.88 -173.71 3.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.882 -0.599 . . . . 74.450000000000003 110.189 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.46 ' OD1' ' HD2' ' A' ' 22' ' ' ARG . 2.1 p30 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 72.150000000000006 111.078 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.9 p -84.43 -41.83 16.24 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.442 . . . . 72.409999999999997 110.82 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.89 -149.84 18.67 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 120.696 -0.764 . . . . 60.409999999999997 111.945 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.4 mt -98.44 133.01 42.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.72 -0.474 . . . . 70.340000000000003 109.72 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -117.03 129.13 55.81 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.276 -0.42 . . . . 62.43 110.698 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.433 HD11 HG23 ' A' ' 43' ' ' ILE . 32.0 mt -107.49 137.5 38.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.784 -1.191 . . . . 60.240000000000002 107.784 173.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 24.4 mt -124.88 129.83 73.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.786 -0.366 . . . . 73.349999999999994 111.172 -176.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.3 tp -122.71 116.23 23.41 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.257 -0.645 . . . . 74.430000000000007 109.257 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -78.35 120.08 22.6 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.366 -0.533 . . . . 75.409999999999997 110.87 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 16.7 m -85.63 -60.73 1.94 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.581 -0.736 . . . . 63.119999999999997 109.898 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 41.2 mm-40 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.31 -0.852 . . . . 62.450000000000003 110.199 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.518 0 CA-C-O 120.898 0.38 . . . . 65.129999999999995 110.843 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HA ' ' OG ' ' A' ' 80' ' ' SER . 35.6 mtm180 -99.34 106.76 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.273 -0.421 . . . . 73.420000000000002 110.275 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.7 m -134.81 154.18 36.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-O 121.077 0.465 . . . . 75.349999999999994 111.665 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 10' ' ' ARG . 22.9 ttt180 -117.7 137.9 52.37 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.842 -0.799 . . . . 74.549999999999997 108.842 174.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.2 m -146.74 148.53 32.05 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.959 0.409 . . . . 75.319999999999993 110.933 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.5 m -102.06 148.52 25.28 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.202 -1.036 . . . . 65.310000000000002 108.202 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.48 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.8 p80 -136.75 132.21 34.47 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.833 0.679 . . . . 71.239999999999995 112.833 -176.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.21 124.8 50.83 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.985 -1.117 . . . . 72.530000000000001 107.985 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.478 HD13 ' CD2' ' A' ' 111' ' ' HIS . 28.8 tp -120.8 124.24 44.59 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.02 0.438 . . . . 75.420000000000002 111.777 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.85 115.66 50.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.414 -0.812 . . . . 40.549999999999997 108.969 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -83.31 175.09 10.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.091 0.472 . . . . 74.299999999999997 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -152.12 162.3 41.31 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.832 -0.622 . . . . 74.310000000000002 110.048 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -56.28 -49.71 73.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.245 0.545 . . . . 74.010000000000005 111.13 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -80.01 40.28 0.47 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.677 -0.692 . . . . 74.010000000000005 111.638 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.7 t -105.98 -173.35 2.28 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.285 -0.635 . . . . 72.0 109.285 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 22' ' ' ARG . 36.2 mtp85 -72.44 -23.92 61.14 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.294 0.568 . . . . 75.409999999999997 109.722 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' ' H ' ' A' ' 25' ' ' SER . 19.4 ttm180 -146.59 114.13 4.39 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 65.239999999999995 110.055 177.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -87.18 21.89 1.0 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.921 2.414 . . . . 62.350000000000001 111.631 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.51 ' H ' ' HG2' ' A' ' 23' ' ' ARG . 15.6 m -126.3 148.1 49.6 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.768 -0.651 . . . . 62.100000000000001 109.877 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.8 t -146.94 -179.3 6.71 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.875 -0.417 . . . . 44.32 109.875 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 54.9 p-90 -84.71 -35.75 22.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.056 0.455 . . . . 74.219999999999999 110.573 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.425 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 3.3 ptm180 -81.0 -21.67 40.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.932 -0.576 . . . . 73.239999999999995 110.781 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -151.8 121.86 7.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.883 -0.599 . . . . 75.439999999999998 109.48 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.0 -41.69 90.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.307 -0.406 . . . . 74.409999999999997 111.345 -176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -122.71 109.24 14.0 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.159 0.504 . . . . 72.530000000000001 111.522 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.1 mm -79.04 105.8 8.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.744 -0.836 . . . . 42.439999999999998 108.744 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 47.6 p -87.75 -21.89 24.89 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.107 -0.497 . . . . 54.310000000000002 112.232 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 34' ' ' ARG . 7.0 ptp85 -66.34 131.77 46.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.074 0.464 . . . . 75.209999999999994 111.104 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -86.76 -179.77 6.62 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.921 -0.582 . . . . 74.430000000000007 110.258 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.64 -43.31 99.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.68 0.276 . . . . 72.5 110.986 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.58 -40.07 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 74.340000000000003 110.869 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.93 -36.49 64.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 73.439999999999998 110.715 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.42 94.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.101 -0.5 . . . . 34.140000000000001 110.769 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.97 -42.12 93.44 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.385 -0.37 . . . . 72.109999999999999 110.91 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -65.73 -42.36 91.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 31.41 110.973 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.43 -52.34 58.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 71.329999999999998 110.925 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.7 mm -53.45 -56.5 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 O-C-N 123.457 0.473 . . . . 64.140000000000001 111.848 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.582 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 51.0 m-80 -61.99 -36.67 82.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.714 0.292 . . . . 73.140000000000001 111.101 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -62.44 -47.03 92.43 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.862 -0.685 . . . . 71.319999999999993 111.926 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 50' ' ' ILE . 21.7 m-85 -57.38 -42.39 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.599 0.238 . . . . 74.5 110.907 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.47 -41.95 79.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.144 0.497 . . . . 41.32 110.505 178.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 71.8 mm-40 -66.73 -42.13 86.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.984 -0.553 . . . . 74.319999999999993 110.682 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.0 mtpp -58.92 -40.7 85.35 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.186 -0.461 . . . . 65.519999999999996 110.703 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 46' ' ' TYR . 82.3 mt -64.89 -42.87 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.703 -0.68 . . . . 74.319999999999993 110.996 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -69.09 -33.17 73.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.429 -0.351 . . . . 71.450000000000003 111.466 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -78.74 -16.03 57.71 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.01 0.434 . . . . 75.319999999999993 110.978 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.72 15.89 67.0 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.848 -0.691 . . . . 61.509999999999998 112.45 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -67.61 -58.29 4.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.21 0.529 . . . . 73.129999999999995 109.873 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -132.6 143.07 49.44 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.434 -0.803 . . . . 70.299999999999997 109.783 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -76.17 157.87 32.28 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 116.185 -0.461 . . . . 75.120000000000005 110.787 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -58.59 -43.9 89.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.94 -0.573 . . . . 75.439999999999998 109.506 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.387 -0.824 . . . . 70.150000000000006 110.488 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.3 t -65.24 -47.02 78.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.951 -0.568 . . . . 74.329999999999998 110.163 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.81 -37.16 81.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.004 -0.544 . . . . 70.010000000000005 111.075 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -65.53 -48.69 71.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.308 -0.406 . . . . 72.120000000000005 111.526 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -76.78 7.92 4.22 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.9 0.704 . . . . 42.229999999999997 112.9 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -135.6 -51.82 0.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.621 0.6 . . . . 71.400000000000006 112.621 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -96.27 -10.11 28.69 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.645 0.609 . . . . 64.439999999999998 112.645 -174.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 33.1 t -87.04 140.52 29.47 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.717 -0.393 . . . . 63.020000000000003 110.389 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.425 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 3.7 m-20 -93.46 13.71 20.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.996 0.427 . . . . 73.109999999999999 110.005 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 47.4 t -76.09 146.86 39.03 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.113 -0.494 . . . . 61.539999999999999 110.531 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.6 t -75.98 -20.49 57.83 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.854 -0.795 . . . . 73.230000000000004 108.854 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.38 -4.72 59.06 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.223 -0.899 . . . . 61.25 110.403 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.75 66.58 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.103 -0.499 . . . . 42.439999999999998 111.04 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -61.83 -26.48 68.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.967 -0.56 . . . . 73.239999999999995 110.608 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.73 24.44 8.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.941 -0.572 . . . . 65.200000000000003 110.135 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 68.2 13.71 9.12 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.911 -0.586 . . . . 72.120000000000005 111.274 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.71 12.01 78.48 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.576 -0.821 . . . . 62.020000000000003 111.848 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -65.88 126.17 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.923 0.392 . . . . 45.299999999999997 111.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -15.38 25.8 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.34 -0.615 . . . . 74.109999999999999 109.34 177.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.34 -166.56 48.03 Favored Glycine 0 N--CA 1.433 -1.561 0 C-N-CA 120.745 -0.74 . . . . 75.409999999999997 111.382 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -87.43 109.93 19.92 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.801 0.334 . . . . 62.310000000000002 110.261 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -116.06 151.36 35.68 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.135 -0.484 . . . . 71.340000000000003 109.993 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.402 ' OG ' ' HA ' ' A' ' 8' ' ' ARG . 13.4 m -149.81 177.48 9.77 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.586 -0.279 . . . . 75.540000000000006 111.124 -177.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 67.17 10.75 7.95 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.529 -0.759 . . . . 63.32 112.38 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 67.71 31.85 76.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.032 -0.604 . . . . 72.310000000000002 112.882 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -82.26 79.05 8.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.155 0.502 . . . . 75.150000000000006 110.678 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.5 tpp -178.26 164.0 1.71 Allowed 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.964 -1.016 . . . . 60.200000000000003 108.376 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -58.0 139.72 53.88 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.573 0.225 . . . . 74.299999999999997 110.572 177.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 53.0 tptt -55.02 -48.63 95.56 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 113.113 0.782 . . . . 62.340000000000003 113.113 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 61.1 Cg_exo -53.12 -37.89 80.13 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 121.97 1.78 . . . . 71.040000000000006 111.874 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -76.26 -43.79 40.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.42 -0.809 . . . . 74.319999999999993 109.707 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.74 -50.21 74.71 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.668 -0.697 . . . . 71.120000000000005 111.472 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -54.6 -32.45 58.74 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.958 -0.564 . . . . 73.010000000000005 111.867 -177.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -86.77 -42.18 13.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.473 -0.33 . . . . 75.540000000000006 111.407 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -64.9 -44.85 88.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.96 0.409 . . . . 75.430000000000007 111.66 -177.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -79.13 -0.79 33.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.304 -0.407 . . . . 53.039999999999999 111.34 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.63 -2.9 24.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.138 -0.483 . . . . 21.539999999999999 110.298 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.3 mt -84.5 140.8 31.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.062 -0.517 . . . . 73.409999999999997 110.778 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.99 -174.61 3.02 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.847 -0.615 . . . . 74.109999999999999 109.59 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.5 m -72.88 100.9 3.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.933 0.397 . . . . 74.5 110.449 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.23 19.77 20.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.879 -0.677 . . . . 52.299999999999997 111.771 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -104.84 147.29 27.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.831 0.348 . . . . 53.310000000000002 110.694 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . 0.424 ' SD ' HD12 ' A' ' 114' ' ' LEU . 56.4 ttp -133.4 135.28 44.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.038 -0.528 . . . . 71.0 110.203 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.478 ' HB2' HD21 ' A' ' 95' ' ' LEU . 16.5 t -92.86 161.62 14.42 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.526 -0.546 . . . . 33.210000000000001 109.526 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.11 -144.25 6.89 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 120.648 -0.786 . . . . 64.030000000000001 112.19 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.4 103.62 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.501 2.134 . . . . 72.209999999999994 112.427 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.72 107.08 19.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.76 -0.459 . . . . 75.25 109.76 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -73.28 112.32 9.23 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.195 0.521 . . . . 71.319999999999993 111.037 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 107' ' ' ASP . 1.9 m -120.85 169.47 10.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.588 -0.733 . . . . 54.43 109.48 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.442 ' H ' HG22 ' A' ' 106' ' ' THR . 1.9 m-20 -51.71 -46.45 63.95 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.694 0.627 . . . . 63.119999999999997 112.694 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 p -77.7 -16.43 58.48 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.552 0.575 . . . . 54.539999999999999 112.552 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 146.15 -158.36 27.67 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.514 -0.851 . . . . 51.210000000000001 111.773 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 34.6 mt -87.73 126.2 41.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 120.858 0.361 . . . . 74.219999999999999 110.423 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.478 ' CD2' HD13 ' A' ' 15' ' ' LEU . 14.4 m-70 -115.23 133.35 56.11 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.107 -0.497 . . . . 73.129999999999995 110.274 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 42.3 mt -101.2 124.34 54.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 N-CA-C 107.606 -1.257 . . . . 70.510000000000005 107.606 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.1 mt -112.74 132.78 60.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 C-N-CA 120.813 -0.355 . . . . 75.329999999999998 111.32 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.424 HD12 ' SD ' ' A' ' 100' ' ' MET . 8.5 tt -133.65 131.39 39.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.193 -0.458 . . . . 64.430000000000007 109.983 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -118.69 130.26 55.74 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.922 -0.399 . . . . 64.319999999999993 109.922 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.33 0.57 14.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.858 0.318 . . . . 74.109999999999999 111.858 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 118.438 -0.791 . . . . 41.409999999999997 110.831 -178.897 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.607 0 CA-C-O 121.106 0.479 . . . . 64.010000000000005 109.732 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -133.0 127.41 34.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.404 -0.816 . . . . 64.120000000000005 109.912 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.9 m -131.9 166.75 28.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 116.328 -0.397 . . . . 44.450000000000003 110.029 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.429 ' H ' ' HB2' ' A' ' 117' ' ' GLU . 58.5 ttt180 -123.75 128.28 49.35 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.699 0.285 . . . . 74.340000000000003 110.867 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -134.32 138.72 45.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.856 -0.611 . . . . 62.439999999999998 110.518 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.4 m -96.92 158.29 15.5 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.563 -1.273 . . . . 55.520000000000003 107.563 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.509 ' CD2' ' HG ' ' A' ' 76' ' ' LEU . 2.1 p80 -147.72 139.34 23.88 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.366 0.876 . . . . 64.019999999999996 113.366 -172.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD23 HD12 ' A' ' 112' ' ' ILE . 56.5 tp -116.72 116.48 27.6 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.155 -0.93 . . . . 73.439999999999998 108.762 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.543 HD13 ' CD2' ' A' ' 111' ' ' HIS . 16.3 tp -109.66 125.28 52.45 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.888 0.375 . . . . 73.439999999999998 110.967 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 p -123.92 136.12 61.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.626 -0.716 . . . . 61.229999999999997 109.85 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -84.71 179.7 7.3 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.457 0.646 . . . . 73.230000000000004 111.501 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.4 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 6.2 p80 -148.65 153.8 38.8 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.184 -0.917 . . . . 73.150000000000006 109.005 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.0 t -44.02 -51.82 7.53 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.997 0.81 . . . . 73.430000000000007 112.583 -176.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -90.08 65.31 6.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.092 0.473 . . . . 65.299999999999997 111.115 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -110.11 168.8 9.17 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.972 -0.558 . . . . 54.119999999999997 109.728 177.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -69.8 -24.92 63.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.159 0.504 . . . . 72.299999999999997 110.189 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -153.55 88.8 3.61 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.811 -0.632 . . . . 63.009999999999998 109.343 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.5 56.53 6.12 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 123.042 2.495 . . . . 61.43 112.546 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.5 m -137.33 125.23 22.66 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.303 -0.408 . . . . 73.109999999999999 110.344 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.5 m -127.4 176.79 7.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.761 0.315 . . . . 61.420000000000002 111.622 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -66.99 -31.14 71.51 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.452 0.538 . . . . 65.549999999999997 112.452 -178.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -86.61 -62.11 1.58 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.169 0.509 . . . . 73.420000000000002 109.791 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -112.35 127.61 56.05 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.612 -0.722 . . . . 73.120000000000005 110.809 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -82.01 -14.06 56.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.98 -0.555 . . . . 45.43 110.772 -178.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -123.58 139.44 54.0 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 65.129999999999995 109.429 176.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.09 102.26 13.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.958 0.408 . . . . 72.430000000000007 110.703 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.1 p -81.43 -41.6 21.61 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.943 -0.571 . . . . 53.140000000000001 110.301 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.514 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 8.4 ptt85 -53.09 117.54 3.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.504 -0.771 . . . . 74.120000000000005 111.964 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.3 t -82.37 -179.25 7.35 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.872 -0.604 . . . . 65.349999999999994 110.639 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -41.11 87.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 63.210000000000001 111.065 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.03 -45.47 94.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.421 -0.354 . . . . 72.439999999999998 111.051 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 47.5 mt-10 -65.69 -41.62 92.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.06 -0.518 . . . . 74.109999999999999 110.434 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.436 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -65.5 -35.77 81.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.148 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.63 -44.49 93.46 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.083 0.468 . . . . 74.5 109.815 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.84 -36.59 80.61 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.84 -0.618 . . . . 62.100000000000001 110.208 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.8 mt -62.2 -42.01 98.89 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.321 -0.4 . . . . 75.019999999999996 110.048 178.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 39' ' ' ALA . 31.6 mm -54.8 -54.43 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 116.224 -0.444 . . . . 74.019999999999996 110.201 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -60.66 -38.35 84.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.771 -0.65 . . . . 71.310000000000002 110.373 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -46.92 93.53 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.859 -0.61 . . . . 64.439999999999998 111.882 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.2 m-85 -61.39 -50.43 72.91 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.862 -0.422 . . . . 72.409999999999997 109.862 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.79 -48.94 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.816 -0.629 . . . . 52.310000000000002 111.165 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -39.61 89.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.257 -0.429 . . . . 70.129999999999995 111.27 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.48 ' HG3' ' OE1' ' A' ' 54' ' ' GLU . 41.9 tttp -67.27 -36.08 80.83 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 120.899 0.381 . . . . 64.310000000000002 110.73 -179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.516 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 91.4 mt -65.28 -47.05 88.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.552 -0.536 . . . . 71.439999999999998 109.552 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.77 -15.01 63.39 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.703 -0.681 . . . . 72.230000000000004 111.538 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.4 m -80.04 -11.77 59.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.952 0.406 . . . . 72.049999999999997 110.411 177.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.16 18.38 74.57 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.788 -0.72 . . . . 65.209999999999994 112.01 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE1' ' HG3' ' A' ' 49' ' ' LYS . 48.1 mt-10 -88.9 -68.35 0.78 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.107 0.479 . . . . 74.510000000000005 109.811 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 73.8 mm-40 -108.37 147.52 31.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.767 -0.652 . . . . 73.109999999999999 109.903 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -93.71 157.52 16.12 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.183 -0.673 . . . . 53.229999999999997 109.183 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -36.29 63.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.002 0.43 . . . . 64.150000000000006 110.814 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -60.76 -34.81 75.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.736 -0.665 . . . . 72.540000000000006 111.093 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.7 t -69.19 -44.76 71.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.171 0.51 . . . . 73.150000000000006 109.974 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.81 -45.81 80.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.741 -0.663 . . . . 61.530000000000001 110.531 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -70.24 -17.8 63.14 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.892 0.701 . . . . 43.310000000000002 112.892 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.7 m -99.01 -24.2 15.0 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.719 0.637 . . . . 64.019999999999996 112.719 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -121.27 -28.3 4.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.136 0.791 . . . . 71.129999999999995 113.136 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -105.81 5.2 30.6 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.114 0.413 . . . . 74.439999999999998 112.114 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -90.97 140.63 29.66 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.654 -0.418 . . . . 71.450000000000003 109.946 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -88.8 -1.4 58.07 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.205 0.526 . . . . 64.420000000000002 110.559 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB2' HD23 ' A' ' 15' ' ' LEU . 46.9 t -87.5 154.57 20.53 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.956 -0.566 . . . . 53.299999999999997 110.474 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 m -74.87 -9.05 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.415 0.626 . . . . 74.310000000000002 109.882 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.9 p -74.2 -5.78 43.95 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.499 -0.773 . . . . 74.129999999999995 110.93 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -29.0 68.87 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.041 -0.527 . . . . 44.030000000000001 109.99 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -68.98 -26.63 65.12 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.539 -0.755 . . . . 64.120000000000005 110.3 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.54 16.06 5.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.165 -0.471 . . . . 42.549999999999997 110.298 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.0 ttt85 69.0 17.53 8.57 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.601 -0.727 . . . . 75.549999999999997 110.434 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.605 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 69.31 29.27 71.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.613 -0.721 . . . . 61.119999999999997 113.137 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -124.94 135.31 52.71 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 122.614 -0.345 . . . . 74.120000000000005 110.943 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.509 ' HG ' ' CD2' ' A' ' 13' ' ' HIS . 75.5 mt -91.35 -11.22 38.53 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 71.209999999999994 111.302 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.77 -158.18 49.73 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.405 -0.902 . . . . 33.329999999999998 110.908 -176.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.9 117.44 27.9 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.84 0.352 . . . . 52.109999999999999 110.505 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -118.06 166.49 12.48 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 109.664 -0.495 . . . . 73.099999999999994 109.664 178.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -96.23 170.8 9.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.047 0.451 . . . . 72.219999999999999 111.243 -177.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -69.93 132.04 45.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.604 -0.725 . . . . 71.530000000000001 110.919 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.42 39.79 25.18 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.918 -0.658 . . . . 70.230000000000004 112.126 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -123.62 -4.69 8.19 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.158 0.429 . . . . 74.010000000000005 112.158 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 35.4 tpp -125.89 173.96 8.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.666 -0.414 . . . . 54.420000000000002 111.29 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -54.55 145.33 18.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.475 -0.33 . . . . 75.109999999999999 110.789 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 27.2 tptp -48.39 -54.46 25.7 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 113.457 0.91 . . . . 71.319999999999993 113.457 -176.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 29.4 Cg_endo -62.41 -26.79 76.9 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.12 1.88 . . . . 64.129999999999995 112.761 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -84.8 -43.23 14.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.144 0.497 . . . . 73.519999999999996 109.706 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.5 -50.98 70.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.063 -0.971 . . . . 73.329999999999998 110.922 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.18 -48.61 77.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.644 -0.707 . . . . 65.530000000000001 111.558 -178.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.72 77.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.186 -0.461 . . . . 72.099999999999994 112.043 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.45 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 71.7 m -59.04 -50.82 72.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.776 0.322 . . . . 63.450000000000003 111.459 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -79.2 -16.55 56.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.543 -0.299 . . . . 72.439999999999998 111.677 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.44 62.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.159 0.504 . . . . 43.219999999999999 109.73 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.7 mt -84.71 -171.38 3.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.566 -0.743 . . . . 74.439999999999998 109.9 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -148.09 -178.88 6.53 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.178 -0.675 . . . . 75.129999999999995 109.178 177.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 116' ' ' THR . 32.5 m -54.53 113.04 1.14 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.595 0.358 . . . . 74.450000000000003 111.957 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 97.36 -6.56 63.45 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.935 -0.65 . . . . 61.039999999999999 113.621 175.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -90.99 149.7 21.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.146 0.498 . . . . 61.200000000000003 111.863 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.6 ttp -131.05 131.51 44.3 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.474 -0.785 . . . . 71.030000000000001 110.323 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 95' ' ' LEU . 28.2 t -87.21 168.29 13.35 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.685 -0.487 . . . . 74.209999999999994 109.685 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.57 -137.28 5.86 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.804 -0.712 . . . . 73.430000000000007 112.532 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.21 108.95 2.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.728 2.285 . . . . 63.0 113.388 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 74.4 t -102.97 104.79 17.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.258 -0.645 . . . . 54.039999999999999 109.258 175.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -76.11 122.88 24.93 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.262 -0.426 . . . . 75.319999999999993 111.445 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.517 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.6 OUTLIER -127.42 -152.77 0.53 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 116.137 -0.483 . . . . 61.439999999999998 109.99 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.517 ' H ' HG22 ' A' ' 106' ' ' THR . 8.7 m-20 -71.4 -65.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.947 0.351 . . . . 75.150000000000006 111.947 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 43.3 t -64.15 -42.92 96.58 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.113 -0.494 . . . . 72.349999999999994 111.729 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.4 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . -179.28 -145.02 6.05 Favored Glycine 0 N--CA 1.436 -1.312 0 C-N-CA 120.179 -1.01 . . . . 70.25 112.512 -178.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.8 mt -96.54 137.95 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 110.171 -0.307 . . . . 75.099999999999994 110.171 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.543 ' CD2' HD13 ' A' ' 15' ' ' LEU . 12.7 m-70 -119.59 130.64 55.22 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.396 -0.365 . . . . 62.299999999999997 110.826 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.672 HD12 HD23 ' A' ' 14' ' ' LEU . 24.6 mt -101.28 130.88 50.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 107.648 -1.242 . . . . 61.25 107.648 172.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.0 120.24 62.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 112.095 0.406 . . . . 74.540000000000006 112.095 -175.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.6 tp -112.84 109.53 19.06 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.971 -0.751 . . . . 73.230000000000004 108.971 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 92' ' ' SER . 80.0 ttt180 -85.39 114.87 22.77 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.584 -0.446 . . . . 73.230000000000004 110.793 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 97' ' ' THR . 6.9 m -84.16 -44.65 13.77 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.913 -0.585 . . . . 73.439999999999998 110.425 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.429 ' HB2' ' H ' ' A' ' 10' ' ' ARG . 32.1 mm-40 . . . . . 0 C--O 1.243 0.726 0 CA-C-O 118.38 -0.819 . . . . 74.420000000000002 110.512 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.492 0 N-CA-C 109.571 -0.529 . . . . 54.229999999999997 109.571 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -125.73 113.42 17.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 73.430000000000007 109.418 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.8 m -111.83 148.4 15.04 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 116.386 -0.37 . . . . 54.030000000000001 110.901 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -126.18 129.15 48.44 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.289 -0.414 . . . . 74.040000000000006 110.103 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.9 155.57 47.97 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.754 -0.657 . . . . 64.439999999999998 110.345 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.2 m -98.35 142.48 29.93 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.973 -1.121 . . . . 74.409999999999997 107.973 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.417 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 1.3 p80 -127.24 129.99 48.79 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.887 0.699 . . . . 71.319999999999993 112.887 -175.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HB3' ' HB ' ' A' ' 112' ' ' ILE . 2.9 tm? -105.71 127.32 53.01 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 106.491 -1.67 . . . . 63.25 106.491 175.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.528 HD11 ' O ' ' A' ' 108' ' ' SER . 38.3 tp -125.56 121.08 32.62 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.641 -0.424 . . . . 65.340000000000003 111.286 -178.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -137.18 130.81 44.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.507 -0.769 . . . . 65.010000000000005 109.729 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 23' ' ' ARG . 51.0 mttp -97.16 -179.97 4.71 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.165 -0.471 . . . . 74.120000000000005 111.206 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.443 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 3.4 p80 -153.5 -179.26 7.6 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.447 -0.575 . . . . 65.120000000000005 109.447 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 p -48.13 -46.15 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.598 0.561 . . . . 75.140000000000001 111.843 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.443 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 78.5 mm-40 -85.34 69.1 10.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.113 0.483 . . . . 75.030000000000001 111.51 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.9 t -144.99 157.78 44.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.068 -0.716 . . . . 71.239999999999995 109.068 176.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.88 -19.54 60.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.94 0.4 . . . . 75.439999999999998 111.308 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.41 ' O ' ' HD3' ' A' ' 17' ' ' LYS . 32.6 tpt180 -123.78 94.94 45.28 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.31 -0.404 . . . . 75.239999999999995 110.321 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -91.53 28.4 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 123.083 2.522 . . . . 60.329999999999998 112.67 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -143.27 128.93 19.23 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.407 -0.36 . . . . 61.229999999999997 110.336 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.37 -168.72 1.85 Allowed 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.098 -0.334 . . . . 74.420000000000002 110.098 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 66.8 p-90 -86.26 -16.65 36.94 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.026 0.441 . . . . 73.109999999999999 110.006 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -100.41 -37.95 8.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 71.310000000000002 110.809 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -131.94 117.36 18.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.489 -0.56 . . . . 71.209999999999994 109.489 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 63.229999999999997 111.888 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -134.24 101.18 4.92 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.045 0.45 . . . . 62.409999999999997 110.509 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.18 93.17 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.993 -0.549 . . . . 73.129999999999995 110.173 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.9 p -88.8 -16.88 30.98 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.049 -0.523 . . . . 74.430000000000007 111.608 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -67.16 124.82 24.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.264 0.554 . . . . 71.310000000000002 111.815 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.2 t -84.28 -177.53 6.67 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.72 -0.673 . . . . 60.329999999999998 110.923 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -57.82 -42.02 83.44 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 122.794 0.438 . . . . 73.430000000000007 111.021 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -57.67 -44.17 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 111.328 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 27.1 mm-40 -69.7 -42.16 74.44 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.878 -0.601 . . . . 70.530000000000001 110.449 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.51 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.01 -44.24 97.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.662 -0.699 . . . . 72.239999999999995 111.482 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -58.47 -45.47 88.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.538 -0.301 . . . . 61.32 111.609 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -61.44 -34.02 74.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.894 0.378 . . . . 75.219999999999999 110.816 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.9 mt -72.29 -41.81 66.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.015 -0.539 . . . . 74.409999999999997 110.019 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.0 mm -58.65 -47.07 89.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.135 -0.484 . . . . 74.019999999999996 109.815 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.549 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 85.8 m-20 -57.48 -43.65 84.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 115.723 -0.672 . . . . 64.239999999999995 109.927 178.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.6 -41.28 97.24 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.722 -0.672 . . . . 74.230000000000004 112.243 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -61.94 -48.83 78.67 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 109.518 -0.549 . . . . 71.530000000000001 109.518 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.83 -42.96 87.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.368 -0.833 . . . . 74.109999999999999 110.702 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 81.3 mm-40 -58.52 -48.06 82.1 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 116.299 -0.41 . . . . 73.409999999999997 110.902 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -59.54 -41.78 90.83 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.894 0.331 . . . . 42.039999999999999 111.894 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 71.9 mt -72.22 -41.47 66.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 74.120000000000005 111.844 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -78.11 -40.07 39.37 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 72.030000000000001 112.373 -178.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.0 t -73.97 -26.3 60.4 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.596 0.236 . . . . 74.209999999999994 110.878 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.44 38.54 5.58 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.573 -0.822 . . . . 54.210000000000001 112.074 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.69 -49.55 7.07 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 72.099999999999994 110.226 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -143.38 173.7 11.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.787 -0.642 . . . . 63.109999999999999 110.305 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -99.15 153.97 18.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.136 -0.484 . . . . 71.040000000000006 110.215 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -55.52 -38.16 68.86 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.005 0.431 . . . . 54.409999999999997 110.264 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.509 ' OE2' ' HD2' ' A' ' 73' ' ' ARG . 35.5 mt-10 -61.68 -30.67 70.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.644 -0.707 . . . . 72.450000000000003 111.283 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.8 t -76.67 -28.93 56.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.347 0.594 . . . . 74.510000000000005 110.453 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -87.84 -47.94 8.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.781 -0.645 . . . . 64.310000000000002 111.081 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -19.98 64.03 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.925 0.713 . . . . 71.120000000000005 112.925 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.686 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 2.7 p -76.65 -20.79 56.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.196 0.813 . . . . 72.319999999999993 113.196 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -128.77 -22.53 3.24 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.931 0.715 . . . . 74.519999999999996 112.931 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -91.56 -10.85 39.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.658 0.614 . . . . 72.420000000000002 112.658 -177.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 34.3 m -84.41 136.21 33.96 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.998 -0.281 . . . . 61.299999999999997 110.244 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -84.96 -11.8 54.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.306 0.574 . . . . 53.020000000000003 109.913 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.466 ' HB2' HD23 ' A' ' 15' ' ' LEU . 30.9 t -79.6 159.7 26.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.317 -0.856 . . . . 74.019999999999996 110.89 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 17.0 m -70.05 -19.0 63.31 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.161 -0.472 . . . . 64.549999999999997 110.138 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.9 m -67.67 -5.03 13.87 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.969 -0.56 . . . . 64.129999999999995 111.421 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -51.99 -51.15 59.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.185 -0.461 . . . . 74.319999999999993 111.285 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.88 4.44 9.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.116 0.413 . . . . 64.049999999999997 112.116 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.3 12.34 37.33 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.964 -0.754 . . . . 71.319999999999993 108.964 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.509 ' HD2' ' OE2' ' A' ' 58' ' ' GLU . 75.9 mtm180 69.33 16.4 8.36 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.791 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.49 3.43 90.53 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.002 -0.618 . . . . 70.420000000000002 113.316 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -73.72 134.6 43.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.085 0.469 . . . . 71.430000000000007 111.025 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.518 ' O ' HD23 ' A' ' 76' ' ' LEU . 4.1 tt -101.69 -19.64 15.32 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.782 -0.821 . . . . 75.030000000000001 108.782 178.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.44 -176.38 48.2 Favored Glycine 0 N--CA 1.437 -1.272 0 CA-C-N 115.56 -0.745 . . . . 63.130000000000003 111.628 -178.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.04 131.98 34.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 120.748 0.309 . . . . 75.200000000000003 110.235 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -133.27 154.44 50.68 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.913 -0.585 . . . . 72.340000000000003 110.02 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 p -95.56 -80.85 0.41 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 111.989 0.366 . . . . 72.310000000000002 111.989 -177.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -161.64 136.97 7.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 72.310000000000002 110.842 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.57 15.93 76.87 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.748 -0.66 . . . . 74.310000000000002 111.474 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -103.87 -36.38 7.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 71.450000000000003 110.824 -176.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.5 tpp -121.23 157.56 30.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.205 -0.452 . . . . 72.129999999999995 109.996 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -48.03 135.7 12.43 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 123.38 0.425 . . . . 73.409999999999997 111.464 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.499 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 12.7 tmtt? -48.6 -52.48 44.11 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 115.64 -0.709 . . . . 50.240000000000002 112.635 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.1 Cg_endo -53.54 -24.14 27.78 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.619 2.212 . . . . 50.119999999999997 113.413 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.561 ' CD2' HG12 ' A' ' 113' ' ' ILE . 31.1 t80 -99.42 -53.36 3.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.056 0.455 . . . . 74.319999999999993 110.586 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -59.86 -48.08 83.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.52 -0.764 . . . . 60.530000000000001 111.386 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -60.76 -45.09 95.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.115 -0.493 . . . . 73.420000000000002 111.683 -178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.92 66.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 51.520000000000003 111.351 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -65.84 -24.16 66.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.237 -0.438 . . . . 45.520000000000003 111.668 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -81.84 -27.51 33.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.412 . . . . 73.019999999999996 110.542 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.61 -28.08 37.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.863 -0.608 . . . . 73.450000000000003 110.887 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.41 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -82.68 133.22 35.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.067 -0.515 . . . . 74.120000000000005 110.546 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -97.09 169.41 9.83 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.322 -0.399 . . . . 64.030000000000001 109.97 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.9 m -55.89 111.28 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.302 -0.408 . . . . 62.039999999999999 111.158 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.31 -13.28 23.54 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.692 -0.766 . . . . 42.210000000000001 112.691 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -91.0 154.63 19.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.908 0.385 . . . . 72.200000000000003 110.958 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.8 ttp -142.23 130.23 21.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.127 -0.488 . . . . 74.109999999999999 110.427 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.41 ' HB2' HD11 ' A' ' 95' ' ' LEU . 38.0 t -78.86 157.46 28.32 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.075 -0.512 . . . . 73.400000000000006 110.321 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.18 -155.88 22.78 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.811 -0.709 . . . . 72.099999999999994 111.776 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.02 105.73 1.41 Allowed 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.636 2.224 . . . . 74.439999999999998 113.232 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.2 110.8 21.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.921 -0.77 . . . . 74.239999999999995 108.921 175.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -83.92 122.47 28.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.214 -0.448 . . . . 63.520000000000003 111.937 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.5 p -142.45 178.57 7.51 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.793 -0.639 . . . . 73.549999999999997 109.779 178.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.21 -31.98 70.94 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.036 0.446 . . . . 73.549999999999997 110.865 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.528 ' O ' HD11 ' A' ' 15' ' ' LEU . 11.8 p -79.74 4.97 14.66 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.63 -0.713 . . . . 75.239999999999995 111.33 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.85 -158.44 14.28 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.845 -0.693 . . . . 70.010000000000005 112.389 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.4 mt -97.93 128.12 49.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 N-CA-C 109.837 -0.431 . . . . 74.230000000000004 109.837 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -110.9 125.54 53.76 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.496 -0.32 . . . . 75.239999999999995 110.812 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.466 ' HB ' ' HB3' ' A' ' 14' ' ' LEU . 59.0 mt -102.17 130.67 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.458 -0.942 . . . . 54.140000000000001 108.458 174.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' CD2' ' A' ' 88' ' ' PHE . 11.0 mt -110.79 107.43 22.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.652 -0.249 . . . . 73.010000000000005 111.202 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.9 tt -104.75 114.81 29.25 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.174 -0.676 . . . . 71.439999999999998 109.174 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -79.39 108.39 12.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.222 -0.444 . . . . 71.510000000000005 110.261 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.2 p -95.07 -64.07 1.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.644 0.979 . . . . 75.530000000000001 113.644 -176.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.344 -0.836 . . . . 74.420000000000002 111.765 -174.901 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 121.292 0.568 . . . . 70.340000000000003 109.877 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.6 mtt180 -107.07 117.51 34.26 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.257 -0.883 . . . . 74.239999999999995 110.021 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.3 m -124.54 148.66 28.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 CA-C-N 116.165 -0.471 . . . . 73.239999999999995 110.366 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.4 ttt180 -103.54 109.06 20.58 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 110.043 -0.355 . . . . 70.120000000000005 110.043 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.8 m -128.88 132.78 47.74 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.299 0.571 . . . . 74.140000000000001 111.318 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 6.8 m -98.1 142.77 29.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 108.247 -1.02 . . . . 54.520000000000003 108.247 176.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.493 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -133.91 129.06 35.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.452 0.908 . . . . 64.349999999999994 113.452 -176.58 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.4 tt -106.78 142.61 36.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 107.645 -1.243 . . . . 75.239999999999995 107.645 174.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.545 HD23 ' HB2' ' A' ' 67' ' ' SER . 46.0 tp -123.75 134.05 53.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.883 0.327 . . . . 75.530000000000001 111.883 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.414 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 14.4 p -117.64 132.62 66.93 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-N 115.758 -0.655 . . . . 70.129999999999995 109.944 175.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.89 158.24 16.88 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.956 0.408 . . . . 73.340000000000003 110.171 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -139.98 158.25 44.36 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.11 -0.496 . . . . 75.120000000000005 109.735 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.2 t -43.76 -59.88 2.04 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.98 0.8 . . . . 74.430000000000007 112.356 -177.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -92.02 66.84 5.04 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.053 0.454 . . . . 71.340000000000003 111.12 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 t -116.0 173.74 6.41 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.067 -0.515 . . . . 75.099999999999994 109.621 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -56.51 -57.21 13.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 53.299999999999997 109.879 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -126.55 97.96 32.69 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 109.37 -0.604 . . . . 72.549999999999997 109.37 175.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -73.73 50.57 2.09 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.387 2.725 . . . . 60.299999999999997 112.295 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -140.82 152.39 45.13 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 116.038 -0.528 . . . . 53.219999999999999 110.172 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.3 p -154.99 -176.4 5.92 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.358 -0.608 . . . . 60.350000000000001 109.358 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -82.64 -3.38 56.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.352 0.596 . . . . 72.329999999999998 109.589 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 58.9 mtp180 -104.99 -43.64 5.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.791 . . . . 74.219999999999999 110.078 -178.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.448 ' HB3' HD13 ' A' ' 32' ' ' ILE . 62.8 tt0 -142.92 118.34 10.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.866 -0.606 . . . . 74.230000000000004 109.894 -178.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.36 -29.27 63.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.926 0.393 . . . . 70.25 111.164 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -123.1 94.11 4.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.232 0.539 . . . . 74.519999999999996 110.241 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 29' ' ' GLN . 42.6 mm -68.73 104.01 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.501 -0.772 . . . . 53.140000000000001 111.39 -178.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.54 -24.07 20.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.044 -0.525 . . . . 74.209999999999994 111.001 177.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HG2' ' H ' ' A' ' 34' ' ' ARG . 4.5 ptt180 -60.64 118.22 6.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.898 -0.592 . . . . 75.400000000000006 110.303 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t -85.15 -174.72 5.4 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.767 -0.651 . . . . 74.530000000000001 112.098 -175.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -57.58 -50.62 72.52 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.559 -0.746 . . . . 70.019999999999996 111.482 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -52.2 -44.01 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.207 -0.451 . . . . 65.549999999999997 111.295 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.562 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 38.8 mt-10 -67.55 -51.14 54.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.9 -0.591 . . . . 72.140000000000001 110.694 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.1 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.02 -0.536 . . . . 51.219999999999999 111.145 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.0 tp -61.93 -44.3 97.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 71.109999999999999 110.722 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -70.27 -33.82 72.04 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.416 -0.356 . . . . 71.150000000000006 111.097 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.6 mt -62.3 -48.35 80.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.988 -0.375 . . . . 72.209999999999994 109.988 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.468 HG23 HG12 ' A' ' 112' ' ' ILE . 29.6 mm -54.08 -60.49 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-N 115.772 -0.649 . . . . 73.230000000000004 111.302 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -63.8 -28.91 70.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 74.209999999999994 111.0 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.479 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -64.43 -54.72 27.58 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 111.609 -0.597 . . . . 70.219999999999999 111.609 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.46 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.3 m-85 -56.73 -45.15 82.13 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.005 -0.368 . . . . 72.230000000000004 110.005 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.465 ' CD1' ' HA2' ' A' ' 102' ' ' GLY . 78.6 mt -54.98 -47.76 76.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.798 -0.637 . . . . 51.149999999999999 110.843 178.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -64.61 -40.13 94.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 63.409999999999997 110.756 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.3 mtpp -64.39 -39.83 94.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.96 0.409 . . . . 74.200000000000003 110.692 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 46' ' ' TYR . 88.4 mt -68.87 -46.91 78.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.21 -0.45 . . . . 74.129999999999995 110.637 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -62.17 -29.08 70.11 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.307 -0.406 . . . . 72.540000000000006 112.04 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 m -77.41 -9.04 58.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.828 0.347 . . . . 72.120000000000005 110.76 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 3.33 83.35 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.002 -0.618 . . . . 75.329999999999998 112.288 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -73.78 -62.54 1.46 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.992 0.425 . . . . 63.43 110.783 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HG3' ' HE3' ' A' ' 49' ' ' LYS . 24.3 mm-40 -101.92 167.15 10.24 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.066 -0.516 . . . . 72.109999999999999 110.682 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -119.66 140.41 50.67 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.531 -0.544 . . . . 53.450000000000003 109.531 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -57.32 -55.6 32.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.8 0.296 . . . . 63.43 111.8 -177.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.405 ' OE2' ' HD3' ' A' ' 73' ' ' ARG . 47.8 mt-10 -53.14 -42.52 66.16 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.686 0.279 . . . . 75.310000000000002 111.351 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.6 m -64.39 -47.28 79.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.294 -0.412 . . . . 72.349999999999994 110.93 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.89 -43.29 79.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 74.120000000000005 111.016 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.618 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -68.53 -10.85 58.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.142 -0.481 . . . . 75.219999999999999 112.273 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.481 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 70.5 m -88.38 -13.19 41.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.775 0.322 . . . . 75.450000000000003 111.267 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -128.62 -36.41 1.85 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.7 0.63 . . . . 64.519999999999996 112.7 -177.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.81 9.1 38.59 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.4 0.518 . . . . 73.5 112.4 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -92.09 114.45 26.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.708 -0.397 . . . . 65.310000000000002 110.06 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.452 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 59.5 m-20 -78.76 51.3 1.08 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.256 0.55 . . . . 61.350000000000001 110.781 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.545 ' HB2' HD23 ' A' ' 15' ' ' LEU . 26.0 t -164.61 178.19 7.51 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.676 -0.693 . . . . 71.239999999999995 109.355 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -67.06 -14.06 62.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.97 0.414 . . . . 51.43 110.713 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.5 m -56.11 -24.77 42.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.738 -0.665 . . . . 75.010000000000005 111.024 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.618 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -61.11 -30.29 70.27 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.923 -0.58 . . . . 62.350000000000001 111.725 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -83.44 -11.46 57.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.063 0.459 . . . . 71.109999999999999 111.043 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.48 13.81 18.94 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.205 -0.452 . . . . 70.439999999999998 111.248 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.405 ' HD3' ' OE2' ' A' ' 58' ' ' GLU . 83.2 mtt180 64.03 11.19 5.94 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.305 -0.407 . . . . 75.239999999999995 111.724 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.401 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.39 -25.08 3.35 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 121.053 -0.594 . . . . 62.450000000000003 112.606 -178.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 13.0 t0 -77.91 126.61 31.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.063 0.459 . . . . 75.219999999999999 111.421 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -103.42 -4.75 23.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.726 -0.67 . . . . 70.349999999999994 110.776 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 78.13 -165.32 51.96 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.194 -1.003 . . . . 70.349999999999994 110.924 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.22 119.26 22.75 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.877 -0.416 . . . . 72.310000000000002 109.877 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 29.4 p90 -127.4 162.7 25.7 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.229 -0.442 . . . . 72.519999999999996 110.83 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.9 t -82.94 135.63 34.83 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.93 -0.577 . . . . 73.310000000000002 109.816 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.401 ' HD3' ' CZ ' ' A' ' 93' ' ' PHE . 31.0 ptt180 -57.35 -31.49 65.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.898 -0.592 . . . . 74.019999999999996 111.939 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.82 73.1 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.662 -0.78 . . . . 53.049999999999997 112.222 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.6 16.37 17.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.957 0.408 . . . . 71.540000000000006 109.966 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.2 tpp -130.39 154.18 47.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.04 -0.527 . . . . 73.430000000000007 110.635 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' OE1' ' HA ' ' A' ' 85' ' ' GLN . 16.0 mm-40 -60.46 144.26 51.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.529 -0.305 . . . . 62.32 110.566 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.477 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 48.2 tptt -59.46 -50.4 87.43 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 113.093 0.775 . . . . 72.230000000000004 113.093 -176.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 16.9 Cg_endo -58.76 -35.43 98.64 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 121.79 1.66 . . . . 75.209999999999994 111.445 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -68.57 -44.37 74.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.582 -0.736 . . . . 73.430000000000007 109.174 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.46 -48.59 80.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.605 -0.725 . . . . 71.400000000000006 110.158 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -55.58 -42.77 75.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.503 -0.771 . . . . 63.039999999999999 111.4 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -70.99 -40.7 71.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.327 -0.397 . . . . 71.150000000000006 110.91 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 m -62.87 -45.22 93.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.039 0.447 . . . . 63.530000000000001 111.328 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.401 ' CZ ' ' HD3' ' A' ' 81' ' ' ARG . 13.1 m-85 -78.65 -6.24 55.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.098 -0.501 . . . . 74.510000000000005 111.587 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.67 -26.3 21.92 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.252 -0.647 . . . . 74.319999999999993 109.252 175.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 101' ' ' SER . 91.0 mt -86.43 179.71 6.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.195 -0.911 . . . . 73.329999999999998 110.787 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -130.21 176.65 7.93 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.548 -0.751 . . . . 74.239999999999995 109.542 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.4 m -61.05 110.16 1.28 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.012 0.434 . . . . 64.450000000000003 111.035 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.39 16.22 32.74 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 121.023 -0.608 . . . . 55.409999999999997 112.502 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -109.72 148.17 31.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.849 0.357 . . . . 72.439999999999998 111.237 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.3 ttp -128.63 127.96 43.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.027 -0.533 . . . . 65.040000000000006 110.473 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.454 ' HB2' HD11 ' A' ' 95' ' ' LEU . 32.1 t -83.05 161.42 21.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.031 -0.531 . . . . 63.25 110.823 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.465 ' HA2' ' CD1' ' A' ' 47' ' ' ILE . . . -84.98 -139.02 4.47 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 115.938 -0.574 . . . . 44.229999999999997 112.405 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.58 106.15 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.821 2.347 . . . . 72.109999999999999 112.665 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.96 123.24 67.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 61.200000000000003 110.483 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -97.12 124.75 41.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.2 -0.455 . . . . 71.010000000000005 109.872 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.2 p -113.5 -60.56 1.87 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.364 0.505 . . . . 51.210000000000001 112.364 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -144.57 -53.01 0.31 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.382 0.512 . . . . 71.310000000000002 112.382 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 m -113.53 -53.67 2.67 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.944 0.35 . . . . 74.230000000000004 111.944 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.38 -169.38 12.61 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 119.973 -1.108 . . . . 63.049999999999997 112.733 -177.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.7 mt -90.78 138.49 19.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.501 -0.555 . . . . 73.129999999999995 109.501 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.543 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 72.9 m-70 -119.89 145.31 46.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.765 0.317 . . . . 61.140000000000001 111.373 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 50.0 mt -100.95 117.35 46.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.469 -1.308 . . . . 74.109999999999999 107.469 173.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 62.6 mt -103.72 110.9 31.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 120.92 0.39 . . . . 73.510000000000005 111.724 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.8 tp -106.09 107.4 18.38 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.815 -0.63 . . . . 72.430000000000007 109.842 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -85.19 100.22 11.61 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.686 -0.487 . . . . 74.129999999999995 109.686 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.2 m -74.15 -38.18 63.8 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.686 -0.688 . . . . 74.239999999999995 110.56 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.257 1.447 0 CA-C-O 118.518 -0.753 . . . . 73.209999999999994 110.318 -178.714 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 121.17 0.51 . . . . 63.340000000000003 110.214 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -113.24 127.04 56.04 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.602 -0.727 . . . . 72.019999999999996 109.784 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.1 m -125.58 143.65 38.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 CA-C-N 116.263 -0.426 . . . . 72.340000000000003 110.514 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 60.6 ttt180 -112.27 122.92 49.08 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.623 -0.51 . . . . 55.119999999999997 109.623 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -134.53 167.64 20.42 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.101 0.476 . . . . 52.530000000000001 111.049 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -122.37 145.33 48.37 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.486 -0.931 . . . . 53.119999999999997 108.486 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.6 p80 -124.06 129.44 50.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.448 -0.501 . . . . 74.140000000000001 112.304 -176.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.652 HD23 HD12 ' A' ' 112' ' ' ILE . 38.4 tp -106.2 119.11 38.37 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 108.506 -0.924 . . . . 74.219999999999999 108.506 176.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.62 HD13 ' NE2' ' A' ' 111' ' ' HIS . 13.8 tp -116.84 120.17 37.68 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.15 0.5 . . . . 63.020000000000003 111.326 -178.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.7 t -118.47 105.92 18.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.0 -1.0 . . . . 74.140000000000001 108.312 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -76.48 168.85 19.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.497 0.665 . . . . 73.200000000000003 111.803 -177.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.437 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 2.0 p80 -139.26 156.26 47.19 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.134 -0.939 . . . . 64.409999999999997 109.828 -178.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 p -51.34 -38.02 50.93 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 123.834 0.709 . . . . 72.209999999999994 112.059 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -74.05 29.96 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.659 0.614 . . . . 73.409999999999997 112.659 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.4 t -113.16 179.42 3.97 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.972 -0.751 . . . . 75.319999999999993 108.972 177.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.416 HH12 ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -83.27 -29.4 28.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.933 0.397 . . . . 71.340000000000003 110.364 -179.733 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -111.19 102.0 51.79 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.098 -0.501 . . . . 74.209999999999994 110.43 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.446 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 66.1 Cg_endo -92.03 34.26 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.998 2.465 . . . . 74.129999999999995 111.712 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.5 p -149.76 158.07 43.82 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.925 0.393 . . . . 74.430000000000007 111.054 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.9 p -148.27 -161.6 1.37 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 72.409999999999997 109.667 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 70.2 p-90 -89.76 -5.58 56.82 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.916 0.389 . . . . 72.129999999999995 110.584 178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -130.71 0.13 4.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.255 -0.43 . . . . 63.329999999999998 111.73 -177.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -148.36 128.72 13.88 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.697 -0.483 . . . . 70.430000000000007 109.697 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.7 -31.34 32.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.495 -0.321 . . . . 75.140000000000001 111.068 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 20.9 ptmt -140.57 106.93 5.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.391 0.615 . . . . 73.549999999999997 111.551 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.6 mm -67.79 102.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.825 -0.805 . . . . 63.049999999999997 108.825 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 m -97.68 -11.44 23.5 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.92 -0.582 . . . . 70.239999999999995 110.674 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -74.7 129.41 37.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.021 -0.536 . . . . 74.099999999999994 110.287 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.477 HG22 ' OE1' ' A' ' 38' ' ' GLU . 9.0 t -87.24 -178.66 6.26 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 120.759 -0.376 . . . . 62.340000000000003 110.027 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -62.87 -44.46 96.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.841 -0.163 . . . . 61.32 111.426 -177.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.7 mp0 -57.04 -44.18 82.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.416 -0.356 . . . . 72.120000000000005 110.567 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.477 ' OE1' HG22 ' A' ' 35' ' ' THR . 42.1 mt-10 -66.97 -43.87 81.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.847 -0.615 . . . . 55.340000000000003 110.727 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.49 -41.21 98.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.015 -0.539 . . . . 74.120000000000005 110.584 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.86 -42.1 92.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.903 -0.59 . . . . 75.209999999999994 110.05 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 50.3 mm-40 -58.39 -41.57 85.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 73.129999999999995 110.474 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.04 -40.73 87.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.856 -0.611 . . . . 52.119999999999997 110.036 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.5 mm -53.55 -49.47 55.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.674 -0.694 . . . . 61.109999999999999 111.066 179.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -55.23 -47.07 75.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.162 0.506 . . . . 73.329999999999998 110.191 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -57.33 -47.29 89.04 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.437 -0.801 . . . . 51.229999999999997 112.257 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.3 m-85 -59.94 -52.3 66.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.347 0.118 . . . . 74.099999999999994 110.948 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -56.22 -45.95 81.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.023 0.439 . . . . 75.319999999999993 110.705 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -66.21 -42.01 89.35 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.887 -0.597 . . . . 75.409999999999997 112.142 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 30.0 mtpp -63.58 -37.98 89.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.621 0.248 . . . . 64.150000000000006 111.491 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 46' ' ' TYR . 79.0 mt -66.33 -48.16 81.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.39 -0.368 . . . . 55.43 110.718 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -69.98 -18.49 63.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.345 -0.389 . . . . 63.5 111.924 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -91.12 1.05 57.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.912 0.387 . . . . 71.230000000000004 110.741 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.08 30.27 69.98 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.999 -0.546 . . . . 75.120000000000005 113.363 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -92.11 -53.13 4.38 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.506 -0.408 . . . . 72.319999999999993 110.655 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 39.3 mt-10 -137.1 148.02 46.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.08 -0.509 . . . . 74.209999999999994 110.077 178.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -81.89 160.82 23.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.149 -0.478 . . . . 73.099999999999994 111.093 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -62.81 -53.9 47.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.935 -0.575 . . . . 75.030000000000001 110.582 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 2.8 mp0 -58.45 -31.24 67.6 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 65.120000000000005 110.509 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 29.7 t -67.23 -52.07 45.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.758 -0.656 . . . . 63.310000000000002 109.652 178.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.24 -33.88 76.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.398 -0.365 . . . . 73.409999999999997 110.858 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -63.89 -32.44 73.96 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.033 -0.53 . . . . 75.030000000000001 111.46 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -95.76 5.72 50.68 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.987 0.423 . . . . 73.510000000000005 111.225 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' SER . 27.8 mt-30 -115.43 -53.96 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.193 0.442 . . . . 64.129999999999995 112.193 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -108.88 -6.76 15.64 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.661 0.986 . . . . 43.539999999999999 113.661 -173.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.445 ' HB2' HD12 ' A' ' 14' ' ' LEU . 11.7 t -78.83 136.92 37.47 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.022 -0.671 . . . . 61.219999999999999 110.599 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -95.63 11.61 32.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.847 -0.615 . . . . 75.329999999999998 110.367 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 48.3 t -81.81 145.2 30.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.699 -0.682 . . . . 63.439999999999998 110.146 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 p -62.4 -26.3 68.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.073 0.463 . . . . 54.020000000000003 110.983 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 m -74.94 -4.99 41.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.73 -0.668 . . . . 65.150000000000006 111.81 -178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.06 65.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.815 0.34 . . . . 71.430000000000007 111.187 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -32.63 74.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.231 0.539 . . . . 74.329999999999998 110.624 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.33 16.36 11.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.849 -0.614 . . . . 73.109999999999999 110.19 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.493 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 12.3 mpt_? 67.45 14.16 9.54 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.402 -0.817 . . . . 73.349999999999994 111.94 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.426 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.35 7.65 88.34 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.738 -0.744 . . . . 44.020000000000003 112.806 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -80.02 136.95 36.7 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.828 0.347 . . . . 61.229999999999997 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 mp -101.49 -21.2 14.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.161 -0.472 . . . . 43.200000000000003 110.109 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.96 -171.04 42.3 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.772 -0.931 . . . . 42.009999999999998 110.772 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.05 107.93 10.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 117.187 0.494 . . . . 64.239999999999995 110.182 179.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.0 p90 -123.59 -174.37 2.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.192 -0.458 . . . . 72.099999999999994 110.756 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -148.87 -165.89 2.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.247 -0.649 . . . . 72.010000000000005 109.247 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -66.63 134.43 52.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.033 0.444 . . . . 73.530000000000001 111.769 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.447 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 102.91 22.91 8.97 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.878 -0.601 . . . . 61.340000000000003 112.375 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -122.99 -34.81 3.11 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.33 0.493 . . . . 54.509999999999998 112.33 -177.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.1 tpp -135.73 171.33 14.61 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.812 -0.355 . . . . 53.030000000000001 111.207 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -55.58 141.61 36.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.315 -0.402 . . . . 72.420000000000002 110.273 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.407 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 86.4 tttt -51.96 -48.57 87.76 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.195 0.813 . . . . 71.019999999999996 113.195 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 73.3 Cg_exo -51.51 -28.79 29.53 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.209 1.939 . . . . 71.439999999999998 113.03 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CD2' HG12 ' A' ' 113' ' ' ILE . 48.1 t80 -95.48 -49.88 5.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.324 0.583 . . . . 74.450000000000003 110.387 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 34.7 tt0 -61.21 -50.22 73.96 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.324 -0.853 . . . . 63.009999999999998 111.557 -176.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.48 -39.64 95.0 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.899 0.381 . . . . 65.099999999999994 111.05 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.61 -32.26 73.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.863 -0.608 . . . . 54.539999999999999 111.231 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -60.19 -31.77 70.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.177 -0.465 . . . . 72.310000000000002 111.294 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -86.81 -19.49 28.93 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.26 -0.427 . . . . 74.219999999999999 110.526 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.93 -42.93 15.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 74.129999999999995 111.395 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 69.8 mt -81.79 145.08 30.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.058 -0.519 . . . . 74.25 110.334 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . 0.517 ' CG ' ' HG2' ' A' ' 99' ' ' GLU . 28.7 ptt180 -80.66 176.9 9.39 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.814 -0.439 . . . . 74.439999999999998 109.814 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -66.71 114.43 5.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.131 -0.486 . . . . 62.210000000000001 110.821 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.39 6.8 38.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.504 -0.855 . . . . 61.109999999999999 113.814 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.517 ' HG2' ' CG ' ' A' ' 96' ' ' ARG . 63.1 mm-40 -88.32 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.387 0.594 . . . . 73.129999999999995 111.905 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.9 tpp -104.44 128.47 52.34 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.163 -0.926 . . . . 74.010000000000005 109.261 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.43 ' CB ' ' HB ' ' A' ' 113' ' ' ILE . 32.8 t -91.74 156.37 17.61 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 116.454 -0.339 . . . . 75.319999999999993 110.223 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.65 -168.2 38.46 Favored Glycine 0 N--CA 1.44 -1.059 0 C-N-CA 120.754 -0.736 . . . . 41.43 111.525 178.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -66.13 102.46 0.56 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.78 2.32 . . . . 75.310000000000002 112.35 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.3 110.95 24.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 60.229999999999997 109.675 178.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -78.08 110.87 13.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.018 -0.537 . . . . 65.430000000000007 111.004 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 m -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.891 -0.781 . . . . 74.129999999999995 108.891 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.416 ' HB2' HH12 ' A' ' 22' ' ' ARG . 7.1 p-10 -60.1 -32.63 71.16 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.082 0.401 . . . . 74.310000000000002 112.082 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 p -79.36 -35.58 40.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.1 0.476 . . . . 54.219999999999999 111.602 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . 0.437 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . 167.97 -162.88 36.68 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 110.863 -0.895 . . . . 72.400000000000006 110.863 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.452 HG21 HG13 ' A' ' 43' ' ' ILE . 31.8 mt -87.64 131.75 34.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 109.782 -0.451 . . . . 74.209999999999994 109.782 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.62 ' NE2' HD13 ' A' ' 15' ' ' LEU . 14.3 m-70 -121.47 139.65 53.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.282 -0.417 . . . . 74.310000000000002 111.163 -178.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.652 HD12 HD23 ' A' ' 14' ' ' LEU . 21.9 mt -109.34 139.5 31.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.15 -1.056 . . . . 74.120000000000005 108.15 173.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.507 HG12 ' CD2' ' A' ' 88' ' ' PHE . 23.5 mt -114.68 129.55 70.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 120.744 0.306 . . . . 53.310000000000002 111.606 -175.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -133.2 119.58 20.05 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 174.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -84.2 108.26 16.99 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.99 0.424 . . . . 65.219999999999999 109.938 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 m -70.18 -51.96 27.09 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.626 -0.715 . . . . 62.119999999999997 110.241 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.427 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 75.0 mm-40 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.39 -0.814 . . . . 61.439999999999998 109.51 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.885 0.374 . . . . 62.450000000000003 110.625 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -109.97 96.12 6.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.453 -0.573 . . . . 73.0 109.453 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.2 p -109.92 145.33 16.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 116.205 -0.452 . . . . 51.310000000000002 110.793 -177.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HB3' ' HG3' ' A' ' 117' ' ' GLU . 78.8 ttt180 -109.74 120.44 42.49 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.14 -0.482 . . . . 74.519999999999996 110.237 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -134.3 154.47 51.3 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.946 -0.57 . . . . 62.450000000000003 110.403 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 m -98.37 149.26 22.83 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.255 -1.017 . . . . 63.530000000000001 108.255 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.561 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -148.06 136.96 21.89 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.283 0.564 . . . . 74.209999999999994 112.51 -176.677 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.5 tt -106.98 140.77 39.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.271 -0.877 . . . . 70.420000000000002 108.817 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -132.91 127.08 33.54 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 110.054 -0.35 . . . . 61.039999999999999 110.054 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -122.27 127.83 75.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.018 0.437 . . . . 71.409999999999997 110.173 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -91.82 171.8 8.9 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.236 0.541 . . . . 52.409999999999997 111.032 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -152.37 163.03 40.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.87 -0.604 . . . . 73.129999999999995 109.848 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.8 t -54.64 -41.63 70.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.253 0.549 . . . . 74.349999999999994 110.189 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.01 62.31 6.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.873 -0.603 . . . . 74.099999999999994 110.113 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.0 t -135.17 165.17 26.01 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.458 -0.571 . . . . 62.409999999999997 109.458 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 73.7 mtm180 -63.2 -34.31 77.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.225 0.536 . . . . 73.510000000000005 110.116 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -129.98 89.49 45.5 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 115.917 -0.583 . . . . 74.519999999999996 110.47 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.43 72.63 5.9 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.657 2.238 . . . . 53.310000000000002 111.167 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -157.36 143.4 17.7 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.964 -0.562 . . . . 60.229999999999997 109.941 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.4 p -144.84 172.58 12.82 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.684 0.278 . . . . 72.5 110.551 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -88.68 -5.19 58.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.412 0.625 . . . . 75.0 109.434 177.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 43.0 mtp180 -98.63 -48.36 5.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.097 -0.956 . . . . 75.239999999999995 111.087 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -114.63 146.93 40.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.152 -0.477 . . . . 73.349999999999994 110.56 -175.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -83.58 -47.22 11.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 74.549999999999997 110.25 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -121.42 116.96 25.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.381 -0.6 . . . . 51.340000000000003 109.381 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.6 mm -75.98 94.02 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.176 -0.465 . . . . 72.239999999999995 111.442 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 m -87.54 -25.59 23.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.279 0.562 . . . . 73.319999999999993 110.096 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HA ' ' OE2' ' A' ' 38' ' ' GLU . 9.1 ptt180 -60.43 119.47 8.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.362 -0.836 . . . . 73.329999999999998 111.834 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -80.72 -178.14 6.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.878 -0.601 . . . . 55.219999999999999 110.644 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.16 -35.19 79.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.466 -0.334 . . . . 75.120000000000005 110.504 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -64.01 -43.16 96.47 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.3 -0.409 . . . . 62.310000000000002 110.976 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 42.4 mt-10 -62.7 -41.37 99.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 74.219999999999999 110.653 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.505 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.11 -40.3 97.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.134 -0.484 . . . . 63.219999999999999 110.21 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.67 -42.46 91.3 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.7 -0.682 . . . . 63.450000000000003 109.974 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -59.54 -42.08 91.5 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.276 -0.42 . . . . 75.230000000000004 110.595 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.8 mt -62.04 -45.85 91.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.973 -0.558 . . . . 75.299999999999997 110.419 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 39' ' ' ALA . 42.9 mm -55.99 -53.15 41.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.155 -0.475 . . . . 74.040000000000006 110.817 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 88.5 m-20 -59.49 -43.7 93.26 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.471 -0.332 . . . . 74.450000000000003 110.592 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.42 -49.94 71.64 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.963 -0.562 . . . . 65.129999999999995 112.096 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.2 m-85 -61.04 -51.96 66.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.327 0.108 . . . . 75.140000000000001 110.784 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.426 HG22 ' HE2' ' A' ' 51' ' ' LYS . 69.7 mt -54.75 -43.29 66.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.829 0.347 . . . . 71.140000000000001 111.117 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 14.6 mm100 -63.81 -45.58 88.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.398 -0.365 . . . . 55.140000000000001 111.141 178.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -69.01 -36.26 77.6 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 111.842 0.312 . . . . 64.230000000000004 111.842 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 46' ' ' TYR . 83.9 mt -61.42 -49.74 83.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.291 . . . . 64.200000000000003 110.744 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HE2' HG22 ' A' ' 47' ' ' ILE . 52.0 mtmt -64.66 -34.94 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.219999999999999 111.472 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.8 m -65.51 -31.29 72.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.304 -0.407 . . . . 72.0 111.497 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.91 25.65 6.72 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.562 -0.827 . . . . 63.149999999999999 111.826 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -89.24 -75.41 0.44 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.118 0.485 . . . . 40.450000000000003 110.207 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 8.7 mm-40 -109.67 146.3 35.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.66 -0.7 . . . . 70.310000000000002 109.545 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -88.71 159.53 17.76 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 109.643 -0.503 . . . . 74.349999999999994 109.643 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -53.59 -42.01 67.17 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.639 0.257 . . . . 71.510000000000005 111.126 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.49 -12.74 61.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.386 -0.37 . . . . 74.510000000000005 111.559 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -80.01 -29.75 39.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.056 0.455 . . . . 45.130000000000003 110.313 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.2 -45.86 7.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.176 -0.465 . . . . 72.310000000000002 111.42 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.99 67.27 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.734 0.642 . . . . 72.430000000000007 112.734 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.629 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 15.0 m -88.91 -3.25 58.79 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.312 0.486 . . . . 64.540000000000006 112.312 -177.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -133.5 -47.32 0.82 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.341 0.497 . . . . 73.239999999999995 112.341 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -99.25 23.79 8.76 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.132 0.419 . . . . 71.109999999999999 112.132 -174.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -112.47 127.63 56.1 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.083 0.468 . . . . 32.109999999999999 110.375 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.492 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 8.2 m-20 -90.24 65.97 6.48 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.023 -0.535 . . . . 73.129999999999995 110.252 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.2 p -155.87 169.17 25.04 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.134 -0.485 . . . . 71.349999999999994 110.173 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.8 m -69.71 -23.71 63.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.008 0.433 . . . . 74.120000000000005 110.588 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.1 m -67.27 -15.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.901 -0.591 . . . . 70.239999999999995 111.73 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.34 -30.13 70.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.193 0.52 . . . . 71.219999999999999 110.605 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -84.09 -7.95 59.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.925 -0.579 . . . . 72.219999999999999 109.974 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.41 21.72 16.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.583 -0.735 . . . . 65.540000000000006 110.841 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.629 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 26.9 mtp180 69.45 12.93 8.36 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.996 -0.547 . . . . 74.030000000000001 111.699 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.43 -10.31 73.82 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.211 -0.755 . . . . 71.049999999999997 111.211 -177.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -71.58 129.33 38.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.815 0.34 . . . . 54.020000000000003 110.745 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 76' ' ' LEU . 4.8 tt -89.07 -35.47 16.31 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.166 -0.679 . . . . 74.439999999999998 109.166 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.77 -178.02 33.37 Favored Glycine 0 N--CA 1.432 -1.595 0 N-CA-C 110.449 -1.061 . . . . 61.340000000000003 110.449 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 112.97 11.87 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.925 0.362 . . . . 62.409999999999997 110.132 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -116.03 151.57 35.23 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.814 0.34 . . . . 71.219999999999999 111.301 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -169.53 -169.62 0.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.267 -0.642 . . . . 62.539999999999999 109.267 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 63.16 18.77 11.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.215 0.606 . . . . 74.439999999999998 112.521 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 66.0 33.75 86.43 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.863 -0.684 . . . . 72.510000000000005 112.736 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -83.24 -14.26 53.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.894 0.378 . . . . 64.129999999999995 111.027 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.5 tpp -115.64 154.27 29.78 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.991 -0.55 . . . . 73.540000000000006 109.586 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -51.45 134.49 28.73 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.466 0.479 . . . . 64.310000000000002 111.674 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.7 tptt -56.61 -47.78 98.37 Favored Pre-proline 0 CA--C 1.548 0.88 0 N-CA-C 112.809 0.67 . . . . 54.240000000000002 112.809 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.1 Cg_endo -54.74 -25.18 41.19 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.257 1.972 . . . . 74.430000000000007 111.979 177.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.472 ' CE2' HG12 ' A' ' 113' ' ' ILE . 41.3 t80 -85.84 -43.47 13.26 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.71 -0.677 . . . . 74.310000000000002 109.33 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.6 -51.64 68.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.383 -0.826 . . . . 73.450000000000003 111.31 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . 0.47 ' OD2' ' HE3' ' A' ' 86' ' ' LYS . 8.8 m-20 -54.5 -46.57 73.49 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.535 -0.302 . . . . 71.400000000000006 111.078 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -64.68 -42.24 95.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.806 -0.634 . . . . 74.349999999999994 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -65.68 -45.2 83.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.83 0.348 . . . . 71.340000000000003 111.269 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -65.73 -24.83 67.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.158 -0.474 . . . . 73.349999999999994 111.314 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.76 -5.38 59.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.283 -0.417 . . . . 41.310000000000002 111.574 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 96.6 mt -96.69 143.68 27.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.706 0.289 . . . . 72.439999999999998 110.389 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -92.17 -179.73 5.33 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.345 -0.389 . . . . 72.420000000000002 110.245 176.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.3 m -64.79 125.12 23.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.944 -0.571 . . . . 74.409999999999997 110.324 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.29 21.55 64.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.901 -0.666 . . . . 62.329999999999998 111.999 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.434 ' HG3' HD22 ' A' ' 95' ' ' LEU . 8.3 tp10 -111.81 143.91 41.98 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.037 0.446 . . . . 72.109999999999999 110.917 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -124.79 134.83 52.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.449 -0.796 . . . . 71.430000000000007 109.773 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -80.11 -69.0 0.62 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.009 0.433 . . . . 74.109999999999999 111.02 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.428 ' O ' ' HA ' ' A' ' 112' ' ' ILE . . . 139.69 -142.82 13.07 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 111.188 -0.765 . . . . 72.109999999999999 111.188 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.461 ' HB3' HG21 ' A' ' 43' ' ' ILE . 62.8 Cg_endo -76.45 98.37 1.2 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.552 2.168 . . . . 75.239999999999995 112.933 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -95.08 110.95 24.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.237 -0.653 . . . . 64.439999999999998 109.237 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -82.51 122.94 28.7 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.126 -0.488 . . . . 75.019999999999996 111.834 -177.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.0 p -136.74 174.39 10.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.61 -0.723 . . . . 63.119999999999997 109.669 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -62.99 -31.2 72.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.932 0.396 . . . . 73.140000000000001 110.961 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.4 p -79.76 -5.65 55.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 71.510000000000005 111.793 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 123.1 -156.72 17.52 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.687 -0.768 . . . . 63.299999999999997 111.886 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 48.4 mt -97.62 126.97 50.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.588 0.233 . . . . 75.230000000000004 110.387 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.549 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 93.1 m-70 -114.34 135.44 54.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.517 -0.311 . . . . 75.340000000000003 111.204 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 45.3 mt -105.75 125.37 61.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 107.915 -1.143 . . . . 71.5 107.915 173.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ILE . . . . . 0.472 HG12 ' CE2' ' A' ' 88' ' ' PHE . 32.0 mt -107.71 128.96 62.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.791 0.329 . . . . 65.310000000000002 111.779 -176.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.5 tp -131.44 108.88 9.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.771 -0.649 . . . . 71.329999999999998 109.589 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -81.43 120.84 25.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.74 0.305 . . . . 75.319999999999993 110.68 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 p -100.05 -29.21 12.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.335 -0.393 . . . . 64.299999999999997 111.278 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 20.9 mm-40 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.485 -0.769 . . . . 52.409999999999997 110.697 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.159 0 N-CA-C 111.749 -0.54 . . . . 22.43 111.749 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.8 m -81.63 107.67 14.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.019 0.438 . . . . 73.510000000000005 110.387 -179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -99.23 6.81 46.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 72.209999999999994 111.279 -177.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.2 ptm -150.14 148.02 28.45 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.467 -0.333 . . . . 73.409999999999997 110.92 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -111.28 104.49 56.21 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.938 -0.574 . . . . 65.409999999999997 109.745 178.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.432 ' HG3' HH22 ' A' ' 115' ' ' ARG . 87.3 Cg_endo -88.34 137.98 3.81 Favored 'Trans proline' 0 N--CA 1.443 -1.469 0 C-N-CA 122.386 2.057 . . . . 75.200000000000003 111.912 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.59 -14.06 35.83 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.287 0.565 . . . . 61.329999999999998 109.653 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -127.28 117.17 21.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.345 -0.843 . . . . 73.519999999999996 109.788 179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.52 137.08 57.05 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.063 0 CA-C-N 116.327 -0.397 . . . . 72.109999999999999 110.378 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 36.6 ttt180 -112.31 125.84 54.62 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.464 -0.334 . . . . 75.519999999999996 110.183 179.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -143.23 139.18 30.12 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.0 0.429 . . . . 51.009999999999998 111.204 -179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 15.4 m -98.29 153.87 18.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 108.428 -0.953 . . . . 41.509999999999998 108.428 176.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 145.83 37.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.406 0.891 . . . . 71.120000000000005 113.406 -175.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.432 ' HG ' ' HB2' ' A' ' 65' ' ' SER . 10.4 tt -122.59 141.01 52.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.945 -1.025 . . . . 73.25 108.322 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.59 HD23 ' CD2' ' A' ' 111' ' ' HIS . 2.7 tm? -139.17 131.05 27.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.93 0.395 . . . . 70.420000000000002 110.944 -178.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.414 ' N ' HD22 ' A' ' 15' ' ' LEU . 73.4 t -123.63 126.17 72.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 108.786 -0.82 . . . . 75.200000000000003 108.786 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.449 ' HE2' ' HB3' ' A' ' 26' ' ' SER . 60.8 mttm -71.74 171.48 11.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.063 0.459 . . . . 63.340000000000003 111.236 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -142.31 168.72 19.05 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.805 -0.634 . . . . 64.430000000000007 110.117 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.6 m -56.59 -34.63 67.36 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.896 0.702 . . . . 64.25 112.896 -176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -89.84 12.64 16.66 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 112.416 0.524 . . . . 75.519999999999996 112.416 -177.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.5 m -74.59 154.17 38.68 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 110.335 -0.246 . . . . 62.32 110.335 177.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.15 -42.24 99.41 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.962 0.411 . . . . 61.140000000000001 111.111 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -106.41 104.7 51.61 Favored Pre-proline 0 C--N 1.317 -0.821 0 N-CA-C 109.51 -0.552 . . . . 74.420000000000002 109.51 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.484 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 86.6 Cg_endo -82.93 22.39 0.91 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.886 2.391 . . . . 73.319999999999993 112.36 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.425 ' O ' ' HE3' ' A' ' 17' ' ' LYS . 25.8 p -144.44 155.72 43.87 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.699 -0.482 . . . . 72.319999999999993 109.699 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.449 ' HB3' ' HE2' ' A' ' 17' ' ' LYS . 88.9 p -136.27 -165.94 1.8 Allowed 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 120.773 0.32 . . . . 65.430000000000007 110.276 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 42.1 p-90 -92.66 8.4 39.3 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.343 0.592 . . . . 64.340000000000003 109.868 177.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -134.35 -32.03 1.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.566 -0.743 . . . . 75.400000000000006 111.481 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -116.6 148.19 41.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.855 -0.424 . . . . 52.229999999999997 109.855 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -85.15 -39.81 17.45 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 64.310000000000002 110.74 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 25.4 pttm -143.77 134.93 25.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.925 -0.579 . . . . 75.109999999999999 110.527 178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 41.5 mm -88.63 94.08 4.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.931 0 CA-C-N 116.176 -0.466 . . . . 61.020000000000003 110.143 179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.7 m -82.54 -22.72 34.87 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.717 -0.674 . . . . 70.329999999999998 110.653 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -73.05 134.77 44.71 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.172 -0.467 . . . . 61.310000000000002 111.003 -178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.9 t -92.5 -171.16 2.69 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 116.311 -0.404 . . . . 54.210000000000001 110.23 178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -52.15 -53.87 37.65 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.164 0.585 . . . . 62.130000000000003 111.783 -179.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 13.7 mm-40 -64.39 -39.99 94.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.174 -0.466 . . . . 73.329999999999998 112.221 -177.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.82 -37.9 87.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.897 0.379 . . . . 71.549999999999997 110.91 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -72.59 -35.79 67.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.107 0.48 . . . . 52.329999999999998 109.975 177.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 40.1 tp -62.55 -37.5 86.38 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.531 -0.759 . . . . 64.409999999999997 111.059 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 48.4 mt-10 -60.99 -42.42 98.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.447 -0.342 . . . . 72.219999999999999 110.106 178.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 90.1 mt -63.3 -45.71 90.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.029 -0.532 . . . . 74.109999999999999 109.984 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.449 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.1 mm -54.45 -53.2 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-N 115.766 -0.652 . . . . 75.340000000000003 110.645 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -62.04 -35.33 78.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.049 -0.523 . . . . 73.439999999999998 110.99 179.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -61.33 -48.98 82.33 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.565 -0.614 . . . . 71.299999999999997 111.565 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.447 ' CD1' HD12 ' A' ' 60' ' ' LEU . 15.8 m-85 -56.61 -51.42 68.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.869 0.366 . . . . 72.140000000000001 110.113 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 78.3 mt -55.89 -48.8 77.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.267 0 CA-C-N 115.515 -0.766 . . . . 65.310000000000002 111.316 -179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.78 -42.11 92.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.286 -0.416 . . . . 73.420000000000002 111.493 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 45.1 mtpt -62.97 -42.26 99.78 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 120.794 0.33 . . . . 73.439999999999998 111.113 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 78.9 mt -64.98 -47.94 86.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 116.141 -0.481 . . . . 73.019999999999996 111.024 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -64.17 -32.93 74.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.722 0.296 . . . . 74.109999999999999 111.566 -179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 40.8 m -76.23 -28.37 57.15 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.801 0.334 . . . . 74.200000000000003 111.312 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.35 13.37 28.71 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.397 -0.906 . . . . 74.319999999999993 111.933 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -70.64 -46.49 63.19 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.531 -0.544 . . . . 64.519999999999996 109.531 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 36.7 mt-10 -145.28 177.38 8.85 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.576 -0.738 . . . . 74.510000000000005 109.807 178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -118.55 157.31 27.57 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.01 -0.737 . . . . 72.329999999999998 109.01 177.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -55.16 -24.74 28.13 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.331 0.493 . . . . 43.420000000000002 112.331 -176.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -55.21 -51.0 67.97 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.922 0.341 . . . . 73.420000000000002 111.922 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 41.0 p -70.51 -39.71 73.93 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 120.906 0.384 . . . . 61.310000000000002 110.992 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.447 HD12 ' CD1' ' A' ' 46' ' ' TYR . 3.6 mm? -64.15 -46.94 81.83 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.982 -0.553 . . . . 73.219999999999999 111.336 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.504 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -72.95 -10.37 59.73 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.256 0.465 . . . . 74.430000000000007 112.256 -178.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.619 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 40.5 m -101.49 -52.25 3.27 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 64.329999999999998 111.793 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -102.62 -2.57 28.12 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.01 0.744 . . . . 70.140000000000001 113.01 -174.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -128.69 16.68 6.39 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 120.827 0.346 . . . . 73.409999999999997 111.05 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.432 ' HB2' ' HG ' ' A' ' 14' ' ' LEU . 23.3 t -125.27 149.89 47.59 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.249 -0.432 . . . . 73.400000000000006 111.063 -178.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -92.0 -14.96 28.59 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.581 -0.736 . . . . 74.319999999999993 110.306 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 51.1 m -55.3 134.1 49.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.751 -0.659 . . . . 74.420000000000002 111.241 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 12.6 m -60.02 -25.83 65.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 73.109999999999999 110.808 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 m -68.64 -6.8 28.0 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.077 -0.511 . . . . 70.230000000000004 111.602 179.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.73 -29.1 58.93 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.669 0.387 . . . . 42.200000000000003 111.704 -178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -71.43 -17.32 62.39 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.05 0.453 . . . . 74.510000000000005 110.898 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 73' ' ' ARG . . . -114.16 30.03 7.58 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.84 -0.618 . . . . 52.210000000000001 109.922 178.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.619 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 86.8 mtm180 74.37 10.87 4.2 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.549 -0.751 . . . . 75.049999999999997 112.406 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.504 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 86.17 2.51 85.68 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.843 -0.694 . . . . 62.450000000000003 113.126 177.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.474 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 30.4 t70 -85.23 140.72 30.66 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.903 0.382 . . . . 74.510000000000005 111.247 -178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 83.5 mt -94.01 -12.2 29.16 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 71.420000000000002 110.645 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.435 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 81.09 -166.32 48.22 Favored Glycine 0 N--CA 1.436 -1.351 0 N-CA-C 111.169 -0.773 . . . . 52.310000000000002 111.169 -177.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -84.84 109.11 17.86 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 120.935 0.398 . . . . 72.129999999999995 110.412 179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.9 p90 -115.93 176.45 5.08 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 116.211 -0.449 . . . . 74.209999999999994 110.21 179.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.5 t -121.54 -172.13 2.36 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 110.05 -0.352 . . . . 74.540000000000006 110.05 -178.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 22.3 ptt180 -73.8 149.33 41.76 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.205 -0.452 . . . . 62.409999999999997 110.255 179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 72.96 36.19 57.46 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.792 -0.718 . . . . 23.510000000000002 111.745 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -126.8 -22.91 3.77 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.663 0.268 . . . . 64.120000000000005 111.534 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.434 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 46.8 tpp -131.63 164.54 25.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.736 -0.211 . . . . 74.439999999999998 110.902 -177.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -52.32 139.63 23.83 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.585 -0.279 . . . . 42.399999999999999 110.44 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.479 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 55.8 tptt -51.57 -51.45 69.46 Favored Pre-proline 0 CA--C 1.551 1.004 0 N-CA-C 113.408 0.892 . . . . 73.409999999999997 113.408 -176.142 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.479 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 51.7 Cg_exo -56.32 -28.62 72.97 Favored 'Trans proline' 0 C--N 1.371 1.757 0 C-N-CA 122.073 1.848 . . . . 63.119999999999997 112.741 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.588 ' CE2' HG12 ' A' ' 113' ' ' ILE . 21.4 t80 -90.25 -52.33 4.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.161 -0.472 . . . . 75.329999999999998 110.346 -179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.27 -49.84 76.02 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.736 -0.665 . . . . 72.519999999999996 111.439 -177.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -63.75 -32.7 74.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.12 -0.491 . . . . 73.310000000000002 110.725 -178.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -71.34 -37.16 71.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.042 -0.526 . . . . 62.210000000000001 110.142 178.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.458 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 40.3 m -59.01 -45.19 91.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.276 -0.42 . . . . 73.219999999999999 110.595 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -69.82 -28.31 65.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.394 -0.366 . . . . 65.409999999999997 111.026 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.81 -30.91 59.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 62.450000000000003 111.073 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 89.8 mt -72.2 168.03 19.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.19 -0.459 . . . . 71.340000000000003 110.466 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -104.06 173.52 6.27 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 116.313 -0.403 . . . . 73.319999999999993 109.972 179.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 86.1 m -69.51 116.21 9.66 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.879 -0.415 . . . . 51.340000000000003 109.879 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.51 45.96 5.36 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.888 -0.885 . . . . 51.149999999999999 110.888 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.41 130.86 52.73 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.698 0.285 . . . . 65.25 110.768 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 51.2 ttp -109.3 108.28 18.81 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.114 -0.494 . . . . 71.340000000000003 109.754 178.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.451 ' HB2' HD11 ' A' ' 95' ' ' LEU . 47.7 t -73.25 155.9 39.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.777 -0.647 . . . . 62.030000000000001 110.653 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -82.42 -154.64 15.03 Favored Glycine 0 N--CA 1.435 -1.41 0 CA-C-N 115.775 -0.648 . . . . 53.240000000000002 112.231 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -65.79 104.57 0.69 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.054 2.503 . . . . 71.439999999999998 113.053 -178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 67.9 t -101.78 117.65 47.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.079 -0.51 . . . . 51.200000000000003 109.688 177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.13 124.14 28.99 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.902 0.382 . . . . 72.230000000000004 110.996 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.561 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -135.0 -173.72 3.39 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 116.193 -0.458 . . . . 72.140000000000001 109.927 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.561 ' H ' HG22 ' A' ' 106' ' ' THR . 4.6 m-20 -49.61 -61.9 1.85 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.713 0.805 . . . . 72.450000000000003 112.699 -177.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.5 p -64.8 -37.23 86.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.459 0.54 . . . . 74.5 112.459 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 163.06 -139.19 5.75 Favored Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 120.635 -0.793 . . . . 72.299999999999997 112.009 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 35.5 mt -91.21 129.18 42.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 120.776 0.322 . . . . 71.040000000000006 110.145 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.59 ' CD2' HD23 ' A' ' 15' ' ' LEU . 10.7 m170 -116.69 143.81 45.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.106 -0.497 . . . . 72.349999999999994 110.996 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 52.2 mt -110.73 126.16 68.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 N-CA-C 108.138 -1.06 . . . . 75.209999999999994 108.138 173.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.588 HG12 ' CE2' ' A' ' 88' ' ' PHE . 20.2 mt -108.18 116.44 51.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.65 0.262 . . . . 71.439999999999998 111.295 -176.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.7 tp -113.5 101.65 9.55 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 110.018 -0.364 . . . . 74.319999999999993 110.018 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.458 ' HD2' ' O ' ' A' ' 92' ' ' SER . 75.0 ttt180 -84.7 106.78 16.51 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.669 -0.412 . . . . 75.230000000000004 109.976 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.1 p -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.065 -0.516 . . . . 74.340000000000003 110.719 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.359 -0.829 . . . . 64.230000000000004 110.322 179.851 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.292 0 N-CA-C 111.83 -0.508 . . . . 60.350000000000001 111.83 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -72.14 128.83 36.89 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.711 0.291 . . . . 64.409999999999997 110.282 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.9 m-70 -124.04 127.27 47.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.916 0.388 . . . . 74.209999999999994 112.018 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 87.2 mtp -88.51 71.88 8.88 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.34 -0.985 . . . . 75.430000000000007 108.34 175.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -125.82 138.35 31.84 Favored Pre-proline 0 C--N 1.308 -1.222 0 CA-C-N 115.25 -0.886 . . . . 75.400000000000006 109.837 -176.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.403 ' HB3' HH22 ' A' ' 115' ' ' ARG . 52.6 Cg_exo -54.8 105.32 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.604 2.203 . . . . 51.509999999999998 112.212 178.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.03 -46.94 8.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 116.158 -0.474 . . . . 72.129999999999995 110.295 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.431 ' HG2' ' HB1' ' A' ' 78' ' ' ALA . 74.9 ttt180 -111.75 111.32 22.21 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.562 -0.903 . . . . 74.439999999999998 108.562 177.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.1 m -109.93 160.74 8.77 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.131 0 CA-C-O 121.133 0.492 . . . . 62.200000000000003 111.796 -174.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.556 ' HB3' ' CG ' ' A' ' 117' ' ' GLU . 67.0 ttt180 -133.27 122.57 24.1 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 109.236 -0.653 . . . . 74.519999999999996 109.236 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.5 m -134.78 145.41 48.37 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.074 0.464 . . . . 72.340000000000003 111.336 -177.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 m -99.89 140.95 33.36 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 108.231 -1.026 . . . . 73.510000000000005 108.231 175.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.526 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 9.4 p80 -125.4 133.33 52.54 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.935 0.717 . . . . 74.409999999999997 112.935 -176.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.477 ' HB2' ' CZ ' ' A' ' 57' ' ' PHE . 6.5 tt -112.84 124.04 51.68 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 107.349 -1.352 . . . . 54.43 107.349 174.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HB3' ' HB2' ' A' ' 67' ' ' SER . 39.9 tp -108.89 127.77 54.33 Favored 'General case' 0 C--N 1.31 -1.114 0 N-CA-C 112.23 0.455 . . . . 51.43 112.23 -177.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.3 p -118.03 114.0 43.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.354 -0.839 . . . . 52.350000000000001 108.943 174.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -85.16 175.62 8.86 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.031 -0.531 . . . . 63.399999999999999 111.166 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -145.15 165.59 27.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.108 -0.496 . . . . 73.129999999999995 110.701 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 32' ' ' ILE . 33.3 t -54.93 -52.21 63.68 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.682 0.614 . . . . 71.319999999999993 112.281 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -84.03 38.22 0.64 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.211 0.449 . . . . 52.409999999999997 112.211 -178.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.4 t -91.54 162.63 14.45 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.973 -0.38 . . . . 73.409999999999997 109.973 178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 -12.52 60.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.228 0.537 . . . . 74.420000000000002 110.446 177.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.2 tpm_? -149.69 83.1 6.46 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.499 -0.773 . . . . 72.439999999999998 109.056 177.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -81.46 25.57 0.64 Allowed 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.389 2.726 . . . . 53.140000000000001 112.576 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.0 p -122.9 138.9 54.53 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.522 -0.308 . . . . 65.019999999999996 110.67 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -136.11 -167.08 1.98 Allowed 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.421 -0.354 . . . . 75.319999999999993 110.285 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 68.6 p-90 -83.75 -19.51 35.01 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.257 -0.428 . . . . 74.230000000000004 110.429 178.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -102.73 -43.55 5.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.984 -0.553 . . . . 50.409999999999997 110.97 -177.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -124.07 115.52 21.3 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.3 -0.63 . . . . 72.209999999999994 109.3 -177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -67.93 -31.2 70.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.393 -0.367 . . . . 74.040000000000006 110.605 -178.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 31' ' ' LYS . 20.6 ptmt -134.86 105.99 6.67 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.268 0.556 . . . . 75.209999999999994 111.02 176.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.402 ' O ' ' HA ' ' A' ' 19' ' ' SER . 28.4 mm -71.73 122.32 23.72 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.662 -0.699 . . . . 72.099999999999994 109.281 177.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 36.6 p -104.75 -17.85 14.47 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.426 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.2 ptp85 -65.36 141.8 58.44 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 120.845 0.355 . . . . 73.209999999999994 110.327 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.9 t -97.59 -179.15 4.37 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.448 -0.342 . . . . 64.109999999999999 110.995 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 tttm -56.65 -47.64 79.3 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.911 -0.586 . . . . 62.32 111.464 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 41' ' ' GLU . 10.8 mm-40 -59.18 -45.47 90.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.029 -0.532 . . . . 64.430000000000007 111.097 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -63.65 -38.84 92.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 54.210000000000001 110.505 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -66.12 -40.8 90.96 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 71.540000000000006 110.722 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.0 tp -61.39 -38.98 89.01 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.244 -0.435 . . . . 71.329999999999998 110.433 179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 37' ' ' GLU . 49.2 mt-10 -63.54 -35.47 80.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.919 -0.582 . . . . 74.430000000000007 110.252 177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.8 mt -70.02 -41.36 74.41 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.752 -0.658 . . . . 74.420000000000002 109.946 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.552 HG12 ' O ' ' A' ' 39' ' ' ALA . 48.5 mm -53.51 -55.79 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.963 -0.562 . . . . 54.229999999999997 110.15 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.592 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 93.6 m-20 -57.26 -40.06 76.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.623 -0.717 . . . . 73.209999999999994 110.716 179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.406 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.46 -46.83 93.28 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.98 -0.555 . . . . 71.109999999999999 112.181 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -60.62 -44.73 96.0 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.062 0.458 . . . . 74.140000000000001 109.909 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 43' ' ' ILE . 70.1 mt -56.88 -45.94 83.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 CA-C-N 115.529 -0.76 . . . . 71.340000000000003 111.075 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 66.1 mm-40 -60.6 -44.76 95.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.24 -0.436 . . . . 72.310000000000002 110.979 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.471 ' HD3' ' OE2' ' A' ' 55' ' ' GLU . 66.4 mttm -62.18 -40.96 97.79 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.066 -0.516 . . . . 54.229999999999997 111.63 -177.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 78.5 mt -72.27 -47.82 51.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.184 -0.462 . . . . 63.039999999999999 111.475 -178.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -68.49 -26.6 65.55 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.526 0.565 . . . . 73.25 112.526 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 42.3 m -85.07 -1.19 56.56 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.879 0.371 . . . . 72.120000000000005 111.274 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.44 75.43 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.788 -0.72 . . . . 31.149999999999999 112.417 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -84.54 -54.98 4.38 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.449 -0.575 . . . . 73.329999999999998 109.449 179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.471 ' OE2' ' HD3' ' A' ' 49' ' ' LYS . 43.3 mt-10 -133.37 176.48 8.49 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.23 -0.895 . . . . 74.239999999999995 109.525 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.494 ' O ' HD13 ' A' ' 60' ' ' LEU . 3.1 p30 -122.77 165.26 16.87 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.244 0.545 . . . . 75.109999999999999 111.683 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CZ ' ' HB2' ' A' ' 14' ' ' LEU . 64.5 t80 -61.84 -43.72 98.27 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.176 -0.92 . . . . 75.519999999999996 111.82 -176.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.477 ' CD ' HH21 ' A' ' 73' ' ' ARG . 45.6 mt-10 -64.29 -42.83 96.22 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 112.282 0.475 . . . . 72.209999999999994 112.282 -176.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 29.9 t -66.58 -34.93 79.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.136 0.494 . . . . 72.140000000000001 110.191 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' ASP . 10.5 mp -77.84 -29.69 50.63 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.894 -0.594 . . . . 73.319999999999993 111.11 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.96 -49.2 77.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.774 0.321 . . . . 74.450000000000003 111.281 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.545 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . 26.4 m -75.13 12.04 1.0 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 112.431 0.53 . . . . 45.509999999999998 112.431 -178.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -133.77 -57.51 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.398 . . . . 74.319999999999993 111.731 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -93.61 21.27 6.49 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.925 -0.579 . . . . 73.030000000000001 112.439 -174.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.3 t -118.09 142.43 47.42 Favored 'General case' 0 C--N 1.315 -0.93 0 C-N-CA 120.347 -0.541 . . . . 54.409999999999997 110.468 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -97.54 12.57 32.99 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.891 -0.595 . . . . 74.030000000000001 110.473 -178.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.445 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 36.1 t -98.38 144.4 27.8 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.211 -0.449 . . . . 51.409999999999997 110.807 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 19.1 m -71.14 -16.25 62.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.034 0.445 . . . . 74.25 110.177 177.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.2 m -73.33 -6.78 48.32 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.019 -0.537 . . . . 70.450000000000003 110.693 178.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.545 ' HB1' ' HA ' ' A' ' 62' ' ' SER . . . -67.09 -25.17 66.09 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.961 -0.563 . . . . 60.32 109.897 177.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.8 tppp? -64.57 -35.04 79.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.343 -0.844 . . . . 75.219999999999999 109.488 177.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.0 19.08 3.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.538 -0.756 . . . . 70.230000000000004 110.894 179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.477 HH21 ' CD ' ' A' ' 58' ' ' GLU . 18.9 mtp180 69.61 8.07 6.55 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.273 0.629 . . . . 72.349999999999994 111.785 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 86.19 -9.75 68.72 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.929 -0.653 . . . . 61.340000000000003 113.085 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -84.1 123.93 30.58 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.017 0.436 . . . . 62.140000000000001 111.535 -178.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.3 mt -90.54 -25.38 20.27 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.677 -0.692 . . . . 73.230000000000004 111.028 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.52 -169.54 16.34 Favored Glycine 0 N--CA 1.434 -1.463 0 N-CA-C 111.072 -0.811 . . . . 45.140000000000001 111.072 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 8' ' ' ARG . . . -86.57 109.91 19.45 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-O 121.077 0.465 . . . . 74.430000000000007 111.197 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -118.25 177.13 4.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.922 -0.581 . . . . 72.319999999999993 110.118 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.4 t -141.41 176.49 8.82 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.864 -0.421 . . . . 64.450000000000003 109.864 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.618 ' HD2' ' O ' ' A' ' 81' ' ' ARG . 6.9 ppt_? -60.42 128.79 38.42 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.37 0.605 . . . . 72.310000000000002 111.733 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 111.82 12.0 15.43 Favored Glycine 0 N--CA 1.437 -1.278 0 CA-C-N 115.317 -0.856 . . . . 72.150000000000006 111.354 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -121.97 -33.33 3.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.885 0.374 . . . . 74.430000000000007 110.907 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.464 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 44.1 tpp -112.62 165.31 12.38 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 120.827 0.346 . . . . 61.020000000000003 111.447 -176.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -74.57 148.49 40.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.332 -0.395 . . . . 61.229999999999997 110.052 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.2 tptt -40.69 -55.45 4.49 Favored Pre-proline 0 N--CA 1.484 1.248 0 N-CA-C 114.559 1.318 . . . . 74.349999999999994 114.559 -175.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 14.8 Cg_endo -55.77 -29.02 69.86 Favored 'Trans proline' 0 C--N 1.37 1.688 0 C-N-CA 122.731 2.287 . . . . 50.439999999999998 113.787 -176.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.503 ' CE2' HG12 ' A' ' 113' ' ' ILE . 10.3 t80 -100.53 -39.76 7.76 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.062 0.458 . . . . 62.399999999999999 110.092 -178.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -57.86 -64.28 0.96 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.418 -0.81 . . . . 75.319999999999993 111.414 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.35 -35.41 77.35 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.847 -0.615 . . . . 73.230000000000004 111.391 -176.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -65.41 -33.34 75.73 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 73.450000000000003 111.237 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 71.9 m -64.4 -28.48 69.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.012 0.434 . . . . 74.099999999999994 111.536 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -87.86 -7.27 57.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.297 -0.41 . . . . 75.140000000000001 110.569 179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.72 -3.59 23.45 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.979 -0.555 . . . . 74.510000000000005 111.466 -178.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.5 mt -99.96 135.97 40.58 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 74.319999999999993 111.137 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 35.4 ptt180 -98.15 166.53 11.37 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.787 -0.642 . . . . 74.409999999999997 110.382 178.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.4 m -57.28 123.25 14.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.878 0.371 . . . . 72.209999999999994 111.487 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.5 -6.99 77.96 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.76 -0.733 . . . . 72.109999999999999 112.28 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -93.24 143.92 25.8 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.989 -0.374 . . . . 73.099999999999994 109.989 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 54.7 ttp -135.08 136.16 41.8 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.202 -0.454 . . . . 73.25 110.935 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.5 t -99.6 123.0 43.45 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.962 -0.755 . . . . 71.420000000000002 108.962 177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.35 -76.31 1.31 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.698 -0.763 . . . . 60.310000000000002 113.937 -176.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.68 83.9 1.29 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.716 2.277 . . . . 74.239999999999995 113.862 -176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.518 ' HB ' ' O ' ' A' ' 111' ' ' HIS . 90.1 t -116.6 102.85 14.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.155 -0.683 . . . . 53.439999999999998 109.155 175.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -83.59 122.69 28.92 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.131 0.491 . . . . 72.549999999999997 111.667 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.542 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -131.61 -168.49 2.03 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.857 -0.794 . . . . 73.430000000000007 108.857 178.338 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.542 ' H ' HG22 ' A' ' 106' ' ' THR . 5.5 m-20 -55.0 -56.08 23.74 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.449 0.537 . . . . 62.229999999999997 112.449 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.3 p -71.44 -30.63 66.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.775 0.657 . . . . 71.450000000000003 112.775 -177.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -138.33 6.12 Favored Glycine 0 N--CA 1.439 -1.106 0 C-N-CA 120.311 -0.947 . . . . 62.43 111.892 -178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 49.3 mt -91.7 127.67 43.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 120.929 0.395 . . . . 71.209999999999994 110.528 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.518 ' O ' ' HB ' ' A' ' 104' ' ' VAL . 13.5 m-70 -110.56 128.96 55.88 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.894 -0.593 . . . . 73.409999999999997 109.886 179.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 38.6 mt -99.38 123.51 52.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 N-CA-C 108.895 -0.779 . . . . 72.430000000000007 108.895 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.503 HG12 ' CE2' ' A' ' 88' ' ' PHE . 14.8 mt -107.37 113.9 44.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-N 116.138 -0.483 . . . . 73.25 110.982 -176.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 54.0 tp -104.55 123.81 48.19 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.554 -0.294 . . . . 74.439999999999998 110.54 177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.403 HH22 ' HB3' ' A' ' 6' ' ' PRO . 8.5 tpt180 -87.58 99.16 11.84 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.833 -0.432 . . . . 70.209999999999994 109.833 177.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.5 p -80.87 -46.09 15.81 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.968 -0.56 . . . . 51.530000000000001 111.699 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.556 ' CG ' ' HB3' ' A' ' 10' ' ' ARG . 70.8 mm-40 . . . . . 0 C--O 1.244 0.773 0 CA-C-O 118.695 -0.669 . . . . 75.439999999999998 111.045 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.214 0 N-CA-C 111.823 -0.511 . . . . 60.009999999999998 111.823 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -66.64 -33.13 74.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.043 0.449 . . . . 41.25 110.629 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -96.71 130.66 43.9 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.922 -0.581 . . . . 72.120000000000005 109.7 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 61.3 mtt -75.42 128.53 35.56 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.514 -0.55 . . . . 73.209999999999994 109.514 177.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 73.0 153.45 0.15 Allowed Pre-proline 0 C--O 1.238 0.464 0 O-C-N 124.021 0.826 . . . . 50.409999999999997 110.152 -178.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD2' ' O ' ' A' ' 93' ' ' PHE . 45.4 Cg_exo -57.96 129.27 32.4 Favored 'Trans proline' 0 N--CA 1.463 -0.279 0 C-N-CA 122.257 1.971 . . . . 75.530000000000001 111.404 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.85 -57.86 5.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.497 -0.319 . . . . 71.549999999999997 110.479 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.0 mtt180 -106.98 142.14 37.07 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.657 -0.497 . . . . 73.109999999999999 109.657 177.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.552 HG12 ' NH1' ' A' ' 115' ' ' ARG . 25.9 m -139.38 129.46 31.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-O 120.878 0.37 . . . . 71.439999999999998 111.384 179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 0.7 OUTLIER -100.24 107.38 19.2 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 107.806 -1.183 . . . . 75.040000000000006 107.806 171.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 62.3 m -133.32 144.7 49.83 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.806 -0.634 . . . . 74.510000000000005 111.367 -176.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -103.52 155.8 18.25 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.536 -0.913 . . . . 73.150000000000006 108.536 175.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.507 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.2 p80 -137.68 141.57 41.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.861 0.689 . . . . 74.209999999999994 112.861 -175.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.508 HD23 ' N ' ' A' ' 15' ' ' LEU . 7.4 tt -115.44 143.23 45.6 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 107.796 -1.187 . . . . 74.239999999999995 107.796 176.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.531 HD13 ' CE1' ' A' ' 111' ' ' HIS . 40.7 tp -126.8 124.65 40.16 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.998 0.427 . . . . 74.25 111.9 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.1 t -112.81 118.39 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 115.445 -0.798 . . . . 74.340000000000003 109.056 175.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -86.5 -173.99 4.79 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.5 0.667 . . . . 74.420000000000002 111.284 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -160.65 172.96 16.19 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.062 -0.972 . . . . 72.329999999999998 108.498 178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.7 m -54.05 -42.52 69.3 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.922 0.342 . . . . 64.200000000000003 111.922 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -88.43 54.95 3.22 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.995 0.426 . . . . 75.209999999999994 111.597 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.9 t -108.03 170.07 8.23 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.827 -0.434 . . . . 73.310000000000002 109.827 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.517 ' HA ' ' NE ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -73.28 -30.3 63.32 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.358 0.599 . . . . 71.109999999999999 109.923 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -134.81 94.81 16.17 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.555 -0.748 . . . . 75.109999999999999 109.45 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 85.6 Cg_endo -80.01 33.69 0.51 Allowed 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.095 2.53 . . . . 74.430000000000007 112.263 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -143.66 126.57 16.27 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.937 -0.574 . . . . 52.210000000000001 109.741 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.3 m -135.6 175.64 9.41 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 116.398 -0.364 . . . . 72.019999999999996 110.627 -178.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -73.28 -14.0 61.23 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 111.203 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -91.15 -44.24 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.196 -0.457 . . . . 71.019999999999996 110.548 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -136.31 134.45 37.97 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.928 -0.578 . . . . 65.209999999999994 110.192 -178.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -59.43 -47.84 83.94 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.091 -0.504 . . . . 74.120000000000005 111.069 -179.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 60.7 pttt -126.66 113.43 16.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.051 0.453 . . . . 70.400000000000006 110.485 177.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 47.9 mm -67.45 104.14 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.703 -0.681 . . . . 74.209999999999994 110.199 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.5 m -114.63 96.44 5.75 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 116.017 -0.538 . . . . 73.209999999999994 110.221 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -167.47 134.35 2.26 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.822 -0.626 . . . . 65.400000000000006 110.09 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 t -74.99 174.74 8.9 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 110.735 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -58.05 -38.18 75.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.824 0.345 . . . . 74.540000000000006 110.577 -179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 43.7 mt-10 -58.02 -46.39 85.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.784 -0.644 . . . . 74.109999999999999 110.772 179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 74.5 mm-40 -59.96 -43.46 95.04 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 116.149 -0.478 . . . . 74.140000000000001 111.104 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.406 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -64.25 -42.12 96.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.02 -0.536 . . . . 74.319999999999993 110.254 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.7 tp -63.73 -43.76 95.57 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.671 -0.695 . . . . 63.140000000000001 110.667 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 64.6 mm-40 -59.95 -43.03 95.26 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.08 -0.509 . . . . 73.519999999999996 110.754 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 83.9 mt -63.89 -48.71 75.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.331 -0.395 . . . . 75.040000000000006 110.664 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 39' ' ' ALA . 30.6 mm -55.49 -56.98 9.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.076 -0.511 . . . . 63.030000000000001 111.053 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 39.7 m-80 -60.07 -35.95 76.29 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 116.266 -0.425 . . . . 71.239999999999995 110.892 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.31 -49.48 75.73 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.768 -0.651 . . . . 24.420000000000002 111.979 178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.423 ' OH ' ' HB3' ' A' ' 64' ' ' PHE . 26.6 m-85 -61.24 -47.1 87.62 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 109.978 -0.378 . . . . 74.319999999999993 109.978 178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 80.7 mt -51.12 -51.48 21.91 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.73 -0.668 . . . . 63.32 111.21 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.498 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 68.4 mm-40 -63.18 -40.11 96.59 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.485 -0.325 . . . . 73.329999999999998 111.149 -178.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -62.39 -47.14 85.48 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.945 0.402 . . . . 63.43 110.957 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 57.0 mt -67.77 -46.02 83.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-N 115.914 -0.584 . . . . 75.120000000000005 111.369 -178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -64.45 -38.55 91.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.431 -0.349 . . . . 51.210000000000001 111.527 -179.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 26.1 t -70.62 -20.86 62.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.9 0.381 . . . . 64.310000000000002 110.836 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 94.3 18.4 36.41 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.68 -0.771 . . . . 63.32 112.452 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.2 -66.46 0.54 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.184 0.516 . . . . 71.129999999999995 111.053 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -137.38 161.88 35.1 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.518 -0.765 . . . . 73.439999999999998 110.692 -175.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -78.7 144.87 34.9 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.048 -0.524 . . . . 71.450000000000003 112.089 -177.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -65.04 -41.73 94.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.662 -0.699 . . . . 74.519999999999996 110.055 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -59.83 -33.26 71.52 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.813 -0.631 . . . . 75.420000000000002 110.755 179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 42.9 t -77.89 -34.52 51.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.985 -0.552 . . . . 72.209999999999994 110.619 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 99.1 mt -76.71 -40.85 47.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.475 -0.33 . . . . 75.439999999999998 111.157 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.58 -16.44 63.86 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.252 0.464 . . . . 75.340000000000003 112.252 -177.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.5 p -95.08 -4.65 45.95 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.739 0.304 . . . . 65.129999999999995 111.447 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -126.01 -58.68 1.37 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 120.872 0.368 . . . . 70.340000000000003 111.909 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.423 ' HB3' ' OH ' ' A' ' 46' ' ' TYR . 88.5 m-85 -93.94 38.4 1.08 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.257 -0.429 . . . . 71.310000000000002 112.058 -174.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 11.7 t -121.63 128.62 52.11 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.198 -0.668 . . . . 65.340000000000003 109.198 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -69.37 -28.72 66.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 121.089 0.471 . . . . 74.25 110.755 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.0 p -61.83 143.98 55.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.831 -0.622 . . . . 51.130000000000003 111.295 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 52.2 m -74.56 -8.55 56.7 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.195 0.522 . . . . 73.420000000000002 110.742 179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.7 m -70.46 -4.47 22.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.472 -0.785 . . . . 54.32 111.058 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.53 -32.57 51.15 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.018 -0.537 . . . . 72.409999999999997 111.889 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm -66.24 -33.28 75.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.974 0.416 . . . . 72.530000000000001 110.74 179.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -89.62 7.48 36.27 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.64 -0.504 . . . . 61.43 109.64 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? 64.92 18.37 11.46 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.342 -0.844 . . . . 74.400000000000006 110.87 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 67.76 19.88 71.75 Favored Glycine 0 N--CA 1.443 -0.87 0 CA-C-N 115.719 -0.673 . . . . 50.32 112.577 -179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.74 139.05 31.06 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.872 0.336 . . . . 63.219999999999999 111.14 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 91.0 mt -115.21 2.38 14.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.171 -0.468 . . . . 73.239999999999995 110.766 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.573 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 71.63 -154.94 51.84 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.36 -0.924 . . . . 72.329999999999998 111.062 -177.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -91.87 108.39 19.89 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.859 0.362 . . . . 70.230000000000004 110.299 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -116.42 171.93 7.53 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 116.156 -0.474 . . . . 63.229999999999997 110.675 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 23.2 t -160.7 171.66 18.47 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 120.826 0.346 . . . . 71.450000000000003 111.43 -177.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 64.48 -82.38 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.31 1.044 . . . . 73.340000000000003 112.91 178.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -174.43 86.68 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.581 -0.819 . . . . 21.350000000000001 112.134 -177.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -102.07 -24.07 14.0 Favored 'General case' 0 C--N 1.311 -1.072 0 N-CA-C 109.483 -0.562 . . . . 54.399999999999999 109.483 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . 0.424 ' HG2' ' CD1' ' A' ' 88' ' ' PHE . 35.8 tpp -113.86 172.12 7.18 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.54 -0.754 . . . . 71.25 109.517 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -54.96 141.56 33.31 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.45 0.167 . . . . 72.25 111.221 178.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.447 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 22.5 tptm -50.32 -50.5 70.46 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 113.645 0.98 . . . . 64.530000000000001 113.645 -176.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.447 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 77.0 Cg_exo -52.52 -35.32 66.18 Favored 'Trans proline' 0 C--N 1.371 1.749 0 C-N-CA 121.993 1.796 . . . . 71.319999999999993 112.262 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.424 ' CD1' ' HG2' ' A' ' 84' ' ' MET . 38.1 t80 -82.11 -50.14 9.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.746 -0.661 . . . . 73.010000000000005 110.308 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' HG2' ' HA2' ' A' ' 82' ' ' GLY . 2.5 tp10 -61.25 -30.04 70.21 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.857 -0.61 . . . . 71.099999999999994 111.036 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.6 -29.68 70.2 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.756 -0.657 . . . . 75.150000000000006 110.376 178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.57 -24.48 21.71 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.771 -0.65 . . . . 61.340000000000003 110.922 179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 m -58.82 -41.18 86.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.987 0.422 . . . . 64.439999999999998 111.077 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.412 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 55.0 m-85 -91.24 12.84 18.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.066 -0.516 . . . . 65.019999999999996 111.179 -178.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -85.47 -26.56 26.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.726 0.298 . . . . 72.230000000000004 111.26 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.428 HD22 ' H ' ' A' ' 95' ' ' LEU . 1.4 mm? -79.35 127.77 32.5 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.255 -0.429 . . . . 75.150000000000006 110.497 -178.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -86.01 -67.21 0.83 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.267 -0.424 . . . . 75.439999999999998 111.145 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 65.3 m -138.67 108.06 6.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.61 -0.268 . . . . 73.120000000000005 111.34 -178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.562 ' HA2' ' O ' ' A' ' 115' ' ' ARG . . . 51.56 44.5 53.87 Favored Glycine 0 C--N 1.332 0.337 0 CA-C-N 115.926 -0.579 . . . . 72.549999999999997 113.163 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -106.77 161.48 14.63 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 122.692 -0.299 . . . . 70.109999999999999 110.745 -178.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.4 ttp -124.7 135.6 53.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.201 -0.454 . . . . 54.5 110.239 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.8 t -89.79 151.39 21.82 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 109.613 -0.514 . . . . 74.329999999999998 109.613 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.54 -144.92 4.59 Favored Glycine 0 N--CA 1.44 -1.04 0 C-N-CA 121.011 -0.614 . . . . 34.43 112.756 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.87 103.36 1.0 Allowed 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.67 2.247 . . . . 73.299999999999997 113.184 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -92.89 109.58 21.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.054 -0.521 . . . . 71.450000000000003 109.669 177.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -82.28 127.89 33.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.283 -0.417 . . . . 75.230000000000004 111.457 -178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 38.8 p -138.08 -166.16 1.92 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.806 -0.634 . . . . 61.539999999999999 110.165 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -70.43 -47.3 61.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.791 0.329 . . . . 72.099999999999994 111.33 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.5 m -69.45 -37.77 77.5 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.227 -0.442 . . . . 31.329999999999998 111.377 -177.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.93 -138.95 5.68 Favored Glycine 0 N--CA 1.441 -0.993 0 C-N-CA 120.766 -0.73 . . . . 70.040000000000006 111.696 -178.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.5 mt -108.4 135.9 45.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 110.107 -0.331 . . . . 71.340000000000003 110.107 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.531 ' CE1' HD13 ' A' ' 15' ' ' LEU . 39.7 m-70 -120.4 152.59 37.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.717 0.294 . . . . 74.230000000000004 110.784 -179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 62.9 mt -115.46 128.3 72.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 108.004 -1.11 . . . . 72.010000000000005 108.004 173.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 55.8 mt -116.24 123.08 71.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.542 0.21 . . . . 72.010000000000005 111.112 -177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.0 tp -120.45 120.96 37.43 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.619 -0.264 . . . . 61.409999999999997 111.07 178.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.562 ' O ' ' HA2' ' A' ' 98' ' ' GLY . 18.8 ttt180 -89.08 119.36 29.52 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.576 -0.898 . . . . 71.530000000000001 108.576 175.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.4 m -85.82 -12.9 49.67 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 120.852 0.358 . . . . 75.310000000000002 111.344 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.402 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 39.2 mt-10 . . . . . 0 C--O 1.244 0.768 0 CA-C-O 118.58 -0.724 . . . . 74.239999999999995 110.858 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.236 0 N-CA-C 111.778 -0.529 . . . . 73.340000000000003 111.778 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -148.11 155.56 41.58 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 116.903 0.352 . . . . 72.549999999999997 110.509 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.6 m80 -81.98 -23.68 35.91 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.377 -0.601 . . . . 62.329999999999998 109.377 177.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -85.03 95.68 9.17 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.489 -0.778 . . . . 74.219999999999999 109.227 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -74.71 131.48 79.51 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.76 -0.655 . . . . 75.310000000000002 110.768 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -72.87 163.53 38.12 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 123.138 2.559 . . . . 63.020000000000003 113.022 -178.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -94.22 -12.39 28.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.12 -0.491 . . . . 72.219999999999999 111.228 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -117.59 121.95 42.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.302 -0.408 . . . . 65.5 110.559 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.5 m -136.23 150.49 27.88 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 116.247 -0.433 . . . . 64.040000000000006 110.714 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 74.3 ttt180 -110.44 114.71 28.35 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.914 -0.773 . . . . 62.539999999999999 108.914 176.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 63.2 m -129.01 152.55 48.5 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-O 121.25 0.548 . . . . 72.299999999999997 111.677 -177.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.5 m -104.71 149.93 25.17 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 108.245 -1.02 . . . . 75.329999999999998 108.245 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -139.81 149.29 43.33 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.706 0.632 . . . . 71.129999999999995 112.706 -176.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.537 ' HA ' ' OG ' ' A' ' 65' ' ' SER . 8.8 tt -118.49 131.43 56.25 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 108.361 -0.977 . . . . 73.150000000000006 108.361 175.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.627 ' O ' ' HA ' ' A' ' 65' ' ' SER . 2.6 tm? -123.69 112.12 17.0 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.847 0.356 . . . . 71.219999999999999 110.535 -178.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.409 HG11 HD11 ' A' ' 43' ' ' ILE . 9.3 p -109.99 122.23 64.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.429 0.633 . . . . 70.549999999999997 110.605 178.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -85.03 177.46 7.92 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.597 -0.729 . . . . 75.230000000000004 110.922 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.32 173.85 15.07 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.015 -0.539 . . . . 71.450000000000003 110.371 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.1 p -56.64 -53.59 55.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.258 0.466 . . . . 74.5 112.258 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -89.83 47.16 1.43 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.12 0.486 . . . . 73.5 110.696 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.2 t -92.3 173.91 7.57 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.977 -0.556 . . . . 42.530000000000001 110.419 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.46 ' HD2' ' OD1' ' A' ' 107' ' ' ASP . 46.6 ttt180 -68.89 -22.38 64.19 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.494 -0.928 . . . . 70.329999999999998 108.494 176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.2 tpp180 -150.46 98.61 3.24 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 114.562 -1.199 . . . . 71.420000000000002 108.746 176.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.412 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 71.8 Cg_endo -76.14 26.07 0.42 Allowed 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.214 2.609 . . . . 73.109999999999999 112.971 -178.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.9 m -130.92 147.39 52.56 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.986 -0.552 . . . . 72.310000000000002 109.565 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 89.4 p -134.31 -178.42 5.04 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 120.88 0.371 . . . . 72.409999999999997 110.337 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.499 ' CD1' ' HA ' ' A' ' 66' ' ' ASP . 44.4 p-90 -81.53 -0.78 43.57 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.587 -0.523 . . . . 75.319999999999993 109.587 175.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -102.36 -52.55 3.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.565 -0.743 . . . . 73.25 110.261 -179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -132.65 165.23 24.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.17 -0.468 . . . . 75.340000000000003 111.462 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -80.69 -38.91 28.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.034 -0.53 . . . . 53.119999999999997 111.184 -177.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 17.9 ptmt -135.67 125.58 25.79 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 120.936 0.398 . . . . 54.310000000000002 111.172 -179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 25.1 mm -80.15 122.07 34.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.992 -0.549 . . . . 75.140000000000001 109.811 178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 92.0 m -86.84 -40.44 14.91 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.579 0.228 . . . . 74.540000000000006 111.104 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -63.33 125.87 25.57 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.364 0.602 . . . . 75.329999999999998 111.804 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.421 HG22 ' HG2' ' A' ' 38' ' ' GLU . 9.6 t -81.85 171.25 14.71 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.737 -0.665 . . . . 73.519999999999996 109.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -58.82 -33.48 70.45 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.887 0.375 . . . . 74.329999999999998 110.575 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -63.43 -41.97 98.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.91 -0.586 . . . . 75.450000000000003 110.807 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.421 ' HG2' HG22 ' A' ' 35' ' ' THR . 43.8 mm-40 -71.25 -39.74 71.45 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.966 -0.561 . . . . 71.319999999999993 110.466 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.492 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.39 -40.22 96.63 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.669 -0.696 . . . . 71.430000000000007 110.823 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.87 -43.76 77.44 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.144 -0.48 . . . . 73.25 111.603 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -58.45 -45.96 87.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.166 0.507 . . . . 62.299999999999997 110.287 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.6 mt -66.77 -46.56 74.92 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.5 -0.773 . . . . 64.299999999999997 110.563 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.492 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.2 mm -56.55 -53.67 38.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.896 -0.593 . . . . 70.030000000000001 111.283 -179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.41 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 86.8 m-20 -54.72 -45.27 74.03 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 120.976 0.417 . . . . 75.140000000000001 110.664 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -59.73 -54.14 40.1 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.461 -0.791 . . . . 73.219999999999999 112.52 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 50' ' ' ILE . 28.5 m-85 -57.36 -46.1 83.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 111.71 0.263 . . . . 62.539999999999999 111.71 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.4 mt -55.17 -42.13 63.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 121.053 0.454 . . . . 75.209999999999994 110.871 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 30.3 mm-40 -74.34 -37.76 63.44 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.18 -0.464 . . . . 71.299999999999997 111.194 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 93.5 mttt -66.84 -33.78 76.37 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.472 -0.331 . . . . 73.230000000000004 111.131 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.602 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 89.5 mt -63.55 -43.07 98.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.966 0.412 . . . . 73.010000000000005 110.135 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -76.07 -1.67 27.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.068 -0.515 . . . . 75.109999999999999 111.139 178.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.4 t -103.24 -1.96 28.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.101 -0.5 . . . . 74.310000000000002 110.118 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.48 2.38 90.48 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.996 -0.621 . . . . 74.140000000000001 113.06 178.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -68.56 -65.49 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.993 0.425 . . . . 52.340000000000003 110.554 -179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.602 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 61.3 mm-40 -119.64 151.53 38.55 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.887 -0.597 . . . . 74.349999999999994 110.139 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -97.6 152.87 18.61 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.355 -0.609 . . . . 54.539999999999999 109.355 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -53.8 -40.09 66.05 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.527 -0.306 . . . . 75.430000000000007 111.711 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -65.85 -19.34 65.84 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.679 -0.237 . . . . 73.030000000000001 111.621 -177.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 48.4 t -75.44 -38.0 59.99 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.108 0.48 . . . . 54.539999999999999 110.444 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.15 -40.64 13.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.122 -0.49 . . . . 63.450000000000003 111.112 -178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.67 -32.12 68.82 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.131 0.419 . . . . 62.210000000000001 112.131 -177.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.412 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 28.6 p -82.66 -14.39 54.76 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.248 0.462 . . . . 54.340000000000003 112.248 -178.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -124.12 18.23 9.18 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.324 0.49 . . . . 74.530000000000001 112.324 -176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -139.31 -42.06 0.46 Allowed 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 111.801 0.297 . . . . 64.510000000000005 111.801 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.6 m -64.57 132.09 48.86 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.176 0.512 . . . . 74.340000000000003 112.365 -177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.499 ' HA ' ' CD1' ' A' ' 27' ' ' TRP . 20.8 t70 -84.6 -22.46 29.99 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.791 -0.641 . . . . 74.430000000000007 109.444 174.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -59.34 151.44 23.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.218 -0.901 . . . . 73.340000000000003 110.984 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.2 m -61.25 -13.12 16.29 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.278 0.473 . . . . 51.409999999999997 112.278 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.7 m -76.87 -6.19 51.41 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.592 -0.276 . . . . 70.349999999999994 111.186 177.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.412 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -55.93 -54.78 40.59 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 120.912 0.387 . . . . 72.010000000000005 111.337 -178.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -71.69 -8.41 53.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.161 -0.472 . . . . 74.109999999999999 110.941 -179.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.78 13.75 32.63 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.913 -0.585 . . . . 42.039999999999999 110.174 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 69.91 15.71 7.8 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.267 -0.879 . . . . 71.120000000000005 112.57 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.77 -22.17 41.64 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 121.124 -0.56 . . . . 72.409999999999997 113.031 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -62.24 131.38 49.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.718 0.636 . . . . 74.530000000000001 112.718 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 29.4 mt -100.41 -18.39 16.75 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 72.420000000000002 111.04 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 90.61 -175.43 40.56 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 110.898 -0.881 . . . . 51.539999999999999 110.898 -175.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.79 122.53 24.2 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 116.904 0.352 . . . . 63.329999999999998 110.732 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.0 p90 -133.91 179.2 6.39 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.341 -0.39 . . . . 64.420000000000002 110.399 178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -133.21 175.82 9.05 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-O 120.749 0.309 . . . . 61.039999999999999 110.317 -179.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -78.78 156.38 28.84 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 74.140000000000001 111.391 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.402 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 86.01 28.38 28.67 Favored Glycine 0 N--CA 1.443 -0.843 0 CA-C-N 116.051 -0.522 . . . . 74.540000000000006 111.961 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -127.91 -51.8 1.33 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 111.748 0.277 . . . . 75.109999999999999 111.748 -178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -91.91 175.61 6.82 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.749 0.309 . . . . 45.32 110.793 -177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -65.28 139.33 58.6 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.762 -0.459 . . . . 73.310000000000002 109.762 177.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 22.0 tptm -51.37 -52.06 63.07 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 113.456 0.91 . . . . 62.340000000000003 113.456 -175.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.6 Cg_endo -53.57 -27.33 40.73 Favored 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.419 2.079 . . . . 64.209999999999994 112.906 -179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 75.7 t80 -93.28 -50.86 5.27 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.089 0.471 . . . . 71.409999999999997 110.56 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.402 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 35.2 tt0 -61.94 -46.24 90.19 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.64 -0.709 . . . . 64.519999999999996 111.324 -177.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.29 -40.14 89.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.081 -0.509 . . . . 73.450000000000003 110.608 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -68.29 -31.97 71.8 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.874 -0.603 . . . . 74.120000000000005 110.804 179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.6 m -68.65 -46.09 70.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.12 -0.491 . . . . 72.540000000000006 110.853 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 71.1 m-85 -77.18 -10.23 59.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 74.25 111.619 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -90.23 8.51 32.74 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.116 0.484 . . . . 63.329999999999998 110.496 178.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 79.3 mt -101.57 131.75 47.59 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.857 -0.61 . . . . 64.340000000000003 110.581 178.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 28.5 mtm180 -76.87 172.75 12.63 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.269 -0.423 . . . . 71.439999999999998 110.106 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 55.0 m -55.42 111.88 0.98 Allowed 'General case' 0 C--O 1.24 0.582 0 CA-C-O 121.033 0.444 . . . . 74.319999999999993 111.868 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 74.32 49.77 11.42 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.801 -0.636 . . . . 61.350000000000001 112.765 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -129.19 156.26 44.22 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.878 0.371 . . . . 62.130000000000003 110.995 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.1 ttp -118.3 136.12 53.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.887 -0.597 . . . . 70.5 110.759 -179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.3 t -83.67 159.54 21.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.017 -0.538 . . . . 65.439999999999998 110.902 -178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.0 -171.09 44.28 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 111.33 -0.708 . . . . 32.25 111.33 177.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -65.44 107.01 0.93 Allowed 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.872 2.381 . . . . 72.219999999999999 112.774 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 91.1 t -89.68 120.56 38.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.63 -0.507 . . . . 55.240000000000002 109.63 176.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -95.85 133.37 40.09 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.057 0.456 . . . . 71.010000000000005 111.226 -177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 33.9 p -142.88 -173.71 3.97 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.882 -0.599 . . . . 74.450000000000003 110.189 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.46 ' OD1' ' HD2' ' A' ' 22' ' ' ARG . 2.1 p30 -74.81 -22.82 58.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.85 0.357 . . . . 72.150000000000006 111.078 178.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 11.9 p -84.43 -41.83 16.24 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.442 . . . . 72.409999999999997 110.82 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 161.89 -149.84 18.67 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 120.696 -0.764 . . . . 60.409999999999997 111.945 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 60.4 mt -98.44 133.01 42.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 N-CA-C 109.72 -0.474 . . . . 70.340000000000003 109.72 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -117.03 129.13 55.81 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.276 -0.42 . . . . 62.43 110.698 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.433 HD11 HG23 ' A' ' 43' ' ' ILE . 32.0 mt -107.49 137.5 38.31 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 107.784 -1.191 . . . . 60.240000000000002 107.784 173.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 24.4 mt -124.88 129.83 73.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.786 -0.366 . . . . 73.349999999999994 111.172 -176.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 40.3 tp -122.71 116.23 23.41 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.257 -0.645 . . . . 74.430000000000007 109.257 176.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 70.7 ttt180 -78.35 120.08 22.6 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.366 -0.533 . . . . 75.409999999999997 110.87 -179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 16.7 m -85.63 -60.73 1.94 Allowed 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.581 -0.736 . . . . 63.119999999999997 109.898 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 41.2 mm-40 . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.31 -0.852 . . . . 62.450000000000003 110.199 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.05 0 N-CA-C 111.396 -0.681 . . . . 71.450000000000003 111.396 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.7 p -145.15 147.24 32.27 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 120.726 0.298 . . . . 52.409999999999997 110.639 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -110.95 -14.67 13.92 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.208 0.527 . . . . 73.219999999999999 110.487 178.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.432 ' O ' ' HB2' ' A' ' 5' ' ' GLU . 80.1 mtp -116.77 100.28 7.69 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.379 -0.971 . . . . 62.009999999999998 108.379 177.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 4' ' ' MET . 0.7 OUTLIER 71.17 156.67 0.16 Allowed Pre-proline 0 N--CA 1.472 0.628 0 O-C-N 123.719 0.637 . . . . 73.150000000000006 110.633 -175.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.5 166.74 18.74 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.065 1.843 . . . . 63.340000000000003 111.667 178.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.74 -53.89 2.66 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 120.898 0.38 . . . . 65.129999999999995 110.843 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HA ' ' OG ' ' A' ' 80' ' ' SER . 35.6 mtm180 -99.34 106.76 18.89 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.273 -0.421 . . . . 73.420000000000002 110.275 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.7 m -134.81 154.18 36.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-O 121.077 0.465 . . . . 75.349999999999994 111.665 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 10' ' ' ARG . 22.9 ttt180 -117.7 137.9 52.37 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.842 -0.799 . . . . 74.549999999999997 108.842 174.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.2 m -146.74 148.53 32.05 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-O 120.959 0.409 . . . . 75.319999999999993 110.933 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.5 m -102.06 148.52 25.28 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 108.202 -1.036 . . . . 65.310000000000002 108.202 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.48 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 25.8 p80 -136.75 132.21 34.47 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.833 0.679 . . . . 71.239999999999995 112.833 -176.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 6.1 tt -108.21 124.8 50.83 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 107.985 -1.117 . . . . 72.530000000000001 107.985 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.478 HD13 ' CD2' ' A' ' 111' ' ' HIS . 28.8 tp -120.8 124.24 44.59 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.02 0.438 . . . . 75.420000000000002 111.777 -178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 90.2 t -112.85 115.66 50.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.414 -0.812 . . . . 40.549999999999997 108.969 176.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -83.31 175.09 10.14 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.091 0.472 . . . . 74.299999999999997 111.05 -179.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -152.12 162.3 41.31 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.832 -0.622 . . . . 74.310000000000002 110.048 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -56.28 -49.71 73.47 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.245 0.545 . . . . 74.010000000000005 111.13 -178.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -80.01 40.28 0.47 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.677 -0.692 . . . . 74.010000000000005 111.638 -179.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.7 t -105.98 -173.35 2.28 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.285 -0.635 . . . . 72.0 109.285 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 22' ' ' ARG . 36.2 mtp85 -72.44 -23.92 61.14 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.294 0.568 . . . . 75.409999999999997 109.722 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.51 ' HG2' ' H ' ' A' ' 25' ' ' SER . 19.4 ttm180 -146.59 114.13 4.39 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.376 -0.829 . . . . 65.239999999999995 110.055 177.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -87.18 21.89 1.0 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.921 2.414 . . . . 62.350000000000001 111.631 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.51 ' H ' ' HG2' ' A' ' 23' ' ' ARG . 15.6 m -126.3 148.1 49.6 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.768 -0.651 . . . . 62.100000000000001 109.877 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 7.8 t -146.94 -179.3 6.71 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.875 -0.417 . . . . 44.32 109.875 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 54.9 p-90 -84.71 -35.75 22.31 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.056 0.455 . . . . 74.219999999999999 110.573 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.425 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 3.3 ptm180 -81.0 -21.67 40.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.932 -0.576 . . . . 73.239999999999995 110.781 -179.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -151.8 121.86 7.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.883 -0.599 . . . . 75.439999999999998 109.48 -178.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.0 -41.69 90.74 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.307 -0.406 . . . . 74.409999999999997 111.345 -176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -122.71 109.24 14.0 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-O 121.159 0.504 . . . . 72.530000000000001 111.522 -178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.1 mm -79.04 105.8 8.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 108.744 -0.836 . . . . 42.439999999999998 108.744 177.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 47.6 p -87.75 -21.89 24.89 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.107 -0.497 . . . . 54.310000000000002 112.232 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 34' ' ' ARG . 7.0 ptp85 -66.34 131.77 46.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.074 0.464 . . . . 75.209999999999994 111.104 -177.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -86.76 -179.77 6.62 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.921 -0.582 . . . . 74.430000000000007 110.258 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -62.64 -43.31 99.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.68 0.276 . . . . 72.5 110.986 -178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -54.58 -40.07 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.043 -0.526 . . . . 74.340000000000003 110.869 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.93 -36.49 64.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 73.439999999999998 110.715 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.42 94.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.101 -0.5 . . . . 34.140000000000001 110.769 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.97 -42.12 93.44 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 116.385 -0.37 . . . . 72.109999999999999 110.91 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.0 mm-40 -65.73 -42.36 91.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.029 -0.532 . . . . 31.41 110.973 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.43 -52.34 58.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.241 -0.436 . . . . 71.329999999999998 110.925 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.7 mm -53.45 -56.5 8.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 O-C-N 123.457 0.473 . . . . 64.140000000000001 111.848 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.582 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 51.0 m-80 -61.99 -36.67 82.2 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-O 120.714 0.292 . . . . 73.140000000000001 111.101 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.548 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -62.44 -47.03 92.43 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.862 -0.685 . . . . 71.319999999999993 111.926 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.448 ' O ' HG13 ' A' ' 50' ' ' ILE . 21.7 m-85 -57.38 -42.39 82.05 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.599 0.238 . . . . 74.5 110.907 179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.47 -41.95 79.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 121.144 0.497 . . . . 41.32 110.505 178.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 71.8 mm-40 -66.73 -42.13 86.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.984 -0.553 . . . . 74.319999999999993 110.682 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.0 mtpp -58.92 -40.7 85.35 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.186 -0.461 . . . . 65.519999999999996 110.703 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 46' ' ' TYR . 82.3 mt -64.89 -42.87 96.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.703 -0.68 . . . . 74.319999999999993 110.996 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -69.09 -33.17 73.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.429 -0.351 . . . . 71.450000000000003 111.466 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 50.1 m -78.74 -16.03 57.71 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.01 0.434 . . . . 75.319999999999993 110.978 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.72 15.89 67.0 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.848 -0.691 . . . . 61.509999999999998 112.45 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -67.61 -58.29 4.94 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.21 0.529 . . . . 73.129999999999995 109.873 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -132.6 143.07 49.44 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.434 -0.803 . . . . 70.299999999999997 109.783 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -76.17 157.87 32.28 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 116.185 -0.461 . . . . 75.120000000000005 110.787 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -58.59 -43.9 89.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.94 -0.573 . . . . 75.439999999999998 109.506 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -64.03 -38.1 89.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.387 -0.824 . . . . 70.150000000000006 110.488 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.3 t -65.24 -47.02 78.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.951 -0.568 . . . . 74.329999999999998 110.163 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.81 -37.16 81.62 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.004 -0.544 . . . . 70.010000000000005 111.075 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 65' ' ' SER . . . -65.53 -48.69 71.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.308 -0.406 . . . . 72.120000000000005 111.526 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 40.5 m -76.78 7.92 4.22 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 112.9 0.704 . . . . 42.229999999999997 112.9 -177.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -135.6 -51.82 0.75 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.621 0.6 . . . . 71.400000000000006 112.621 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -96.27 -10.11 28.69 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.645 0.609 . . . . 64.439999999999998 112.645 -174.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.517 ' HB3' ' O ' ' A' ' 61' ' ' ALA . 33.1 t -87.04 140.52 29.47 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.717 -0.393 . . . . 63.020000000000003 110.389 179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.425 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 3.7 m-20 -93.46 13.71 20.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.996 0.427 . . . . 73.109999999999999 110.005 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 47.4 t -76.09 146.86 39.03 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.113 -0.494 . . . . 61.539999999999999 110.531 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.6 t -75.98 -20.49 57.83 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.854 -0.795 . . . . 73.230000000000004 108.854 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.9 m -84.38 -4.72 59.06 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.223 -0.899 . . . . 61.25 110.403 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.13 -30.75 66.58 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.103 -0.499 . . . . 42.439999999999998 111.04 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -61.83 -26.48 68.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.967 -0.56 . . . . 73.239999999999995 110.608 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.73 24.44 8.34 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.941 -0.572 . . . . 65.200000000000003 110.135 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 68.2 13.71 9.12 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.911 -0.586 . . . . 72.120000000000005 111.274 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.71 12.01 78.48 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.576 -0.821 . . . . 62.020000000000003 111.848 -179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -65.88 126.17 27.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.923 0.392 . . . . 45.299999999999997 111.232 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.34 -15.38 25.8 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.34 -0.615 . . . . 74.109999999999999 109.34 177.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 81.34 -166.56 48.03 Favored Glycine 0 N--CA 1.433 -1.561 0 C-N-CA 120.745 -0.74 . . . . 75.409999999999997 111.382 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -87.43 109.93 19.92 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.801 0.334 . . . . 62.310000000000002 110.261 178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -116.06 151.36 35.68 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.135 -0.484 . . . . 71.340000000000003 109.993 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.402 ' OG ' ' HA ' ' A' ' 8' ' ' ARG . 13.4 m -149.81 177.48 9.77 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.586 -0.279 . . . . 75.540000000000006 111.124 -177.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 67.17 10.75 7.95 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.529 -0.759 . . . . 63.32 112.38 176.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 67.71 31.85 76.91 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 121.032 -0.604 . . . . 72.310000000000002 112.882 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -82.26 79.05 8.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.155 0.502 . . . . 75.150000000000006 110.678 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 40.5 tpp -178.26 164.0 1.71 Allowed 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.964 -1.016 . . . . 60.200000000000003 108.376 -178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -58.0 139.72 53.88 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.573 0.225 . . . . 74.299999999999997 110.572 177.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 53.0 tptt -55.02 -48.63 95.56 Favored Pre-proline 0 CA--C 1.548 0.875 0 N-CA-C 113.113 0.782 . . . . 62.340000000000003 113.113 -177.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 61.1 Cg_exo -53.12 -37.89 80.13 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 121.97 1.78 . . . . 71.040000000000006 111.874 178.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -76.26 -43.79 40.28 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.42 -0.809 . . . . 74.319999999999993 109.707 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -59.74 -50.21 74.71 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.668 -0.697 . . . . 71.120000000000005 111.472 -179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -54.6 -32.45 58.74 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.958 -0.564 . . . . 73.010000000000005 111.867 -177.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -86.77 -42.18 13.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.473 -0.33 . . . . 75.540000000000006 111.407 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 19.6 m -64.9 -44.85 88.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.96 0.409 . . . . 75.430000000000007 111.66 -177.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -79.13 -0.79 33.11 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.304 -0.407 . . . . 53.039999999999999 111.34 -178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -104.63 -2.9 24.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.138 -0.483 . . . . 21.539999999999999 110.298 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 94.3 mt -84.5 140.8 31.21 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.062 -0.517 . . . . 73.409999999999997 110.778 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.99 -174.61 3.02 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 115.847 -0.615 . . . . 74.109999999999999 109.59 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.5 m -72.88 100.9 3.02 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 120.933 0.397 . . . . 74.5 110.449 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.23 19.77 20.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.879 -0.677 . . . . 52.299999999999997 111.771 -179.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -104.84 147.29 27.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.831 0.348 . . . . 53.310000000000002 110.694 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . 0.424 ' SD ' HD12 ' A' ' 114' ' ' LEU . 56.4 ttp -133.4 135.28 44.55 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.038 -0.528 . . . . 71.0 110.203 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.478 ' HB2' HD21 ' A' ' 95' ' ' LEU . 16.5 t -92.86 161.62 14.42 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.526 -0.546 . . . . 33.210000000000001 109.526 179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.11 -144.25 6.89 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 120.648 -0.786 . . . . 64.030000000000001 112.19 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.4 103.62 0.82 Allowed 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 122.501 2.134 . . . . 72.209999999999994 112.427 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.5 t -95.72 107.08 19.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 109.76 -0.459 . . . . 75.25 109.76 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -73.28 112.32 9.23 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.195 0.521 . . . . 71.319999999999993 111.037 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 107' ' ' ASP . 1.9 m -120.85 169.47 10.4 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.588 -0.733 . . . . 54.43 109.48 -179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.442 ' H ' HG22 ' A' ' 106' ' ' THR . 1.9 m-20 -51.71 -46.45 63.95 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.694 0.627 . . . . 63.119999999999997 112.694 -178.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 3.3 p -77.7 -16.43 58.48 Favored 'General case' 0 C--N 1.323 -0.543 0 N-CA-C 112.552 0.575 . . . . 54.539999999999999 112.552 -178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 146.15 -158.36 27.67 Favored Glycine 0 N--CA 1.44 -1.037 0 C-N-CA 120.514 -0.851 . . . . 51.210000000000001 111.773 -178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 34.6 mt -87.73 126.2 41.29 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.026 0 CA-C-O 120.858 0.361 . . . . 74.219999999999999 110.423 -178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.478 ' CD2' HD13 ' A' ' 15' ' ' LEU . 14.4 m-70 -115.23 133.35 56.11 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.107 -0.497 . . . . 73.129999999999995 110.274 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 42.3 mt -101.2 124.34 54.82 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 N-CA-C 107.606 -1.257 . . . . 70.510000000000005 107.606 174.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 16.1 mt -112.74 132.78 60.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 C-N-CA 120.813 -0.355 . . . . 75.329999999999998 111.32 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.424 HD12 ' SD ' ' A' ' 100' ' ' MET . 8.5 tt -133.65 131.39 39.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.193 -0.458 . . . . 64.430000000000007 109.983 179.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -118.69 130.26 55.74 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.922 -0.399 . . . . 64.319999999999993 109.922 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.33 0.57 14.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 111.858 0.318 . . . . 74.109999999999999 111.858 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 118.438 -0.791 . . . . 41.409999999999997 110.831 -178.897 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.411 0 N-CA-C 111.851 -0.5 . . . . 74.219999999999999 111.851 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 t -84.4 -57.78 3.01 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.696 0.284 . . . . 70.109999999999999 110.438 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -76.14 -42.03 48.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.087 0.47 . . . . 75.219999999999999 109.969 179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.4 ttt -88.15 111.91 22.13 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.231 -0.655 . . . . 74.420000000000002 109.231 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 29.1 mt-10 -68.48 126.09 92.35 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.065 -0.516 . . . . 71.349999999999994 110.7 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 36.2 Cg_exo -60.97 152.94 67.37 Favored 'Trans proline' 0 C--O 1.237 0.425 0 C-N-CA 122.827 2.351 . . . . 74.430000000000007 112.541 -179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -79.61 -19.4 49.36 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.833 -0.621 . . . . 64.010000000000005 109.732 177.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -133.0 127.41 34.09 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.404 -0.816 . . . . 64.120000000000005 109.912 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.9 m -131.9 166.75 28.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 116.328 -0.397 . . . . 44.450000000000003 110.029 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.429 ' H ' ' HB2' ' A' ' 117' ' ' GLU . 58.5 ttt180 -123.75 128.28 49.35 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 120.699 0.285 . . . . 74.340000000000003 110.867 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.8 m -134.32 138.72 45.15 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.856 -0.611 . . . . 62.439999999999998 110.518 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.4 m -96.92 158.29 15.5 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.563 -1.273 . . . . 55.520000000000003 107.563 175.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.509 ' CD2' ' HG ' ' A' ' 76' ' ' LEU . 2.1 p80 -147.72 139.34 23.88 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 113.366 0.876 . . . . 64.019999999999996 113.366 -172.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD23 HD12 ' A' ' 112' ' ' ILE . 56.5 tp -116.72 116.48 27.6 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.155 -0.93 . . . . 73.439999999999998 108.762 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.543 HD13 ' CD2' ' A' ' 111' ' ' HIS . 16.3 tp -109.66 125.28 52.45 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.888 0.375 . . . . 73.439999999999998 110.967 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 p -123.92 136.12 61.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.626 -0.716 . . . . 61.229999999999997 109.85 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -84.71 179.7 7.3 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.457 0.646 . . . . 73.230000000000004 111.501 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.4 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 6.2 p80 -148.65 153.8 38.8 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.184 -0.917 . . . . 73.150000000000006 109.005 178.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.0 t -44.02 -51.82 7.53 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 123.997 0.81 . . . . 73.430000000000007 112.583 -176.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -90.08 65.31 6.45 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.092 0.473 . . . . 65.299999999999997 111.115 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.8 t -110.11 168.8 9.17 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.972 -0.558 . . . . 54.119999999999997 109.728 177.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -69.8 -24.92 63.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.159 0.504 . . . . 72.299999999999997 110.189 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 21.9 tpt180 -153.55 88.8 3.61 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 115.811 -0.632 . . . . 63.009999999999998 109.343 177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -80.5 56.53 6.12 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 123.042 2.495 . . . . 61.43 112.546 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.5 m -137.33 125.23 22.66 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.303 -0.408 . . . . 73.109999999999999 110.344 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.5 m -127.4 176.79 7.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.761 0.315 . . . . 61.420000000000002 111.622 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 7.5 p-90 -66.99 -31.14 71.51 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.452 0.538 . . . . 65.549999999999997 112.452 -178.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.9 mtp180 -86.61 -62.11 1.58 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.169 0.509 . . . . 73.420000000000002 109.791 177.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -112.35 127.61 56.05 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.612 -0.722 . . . . 73.120000000000005 110.809 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -82.01 -14.06 56.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.98 -0.555 . . . . 45.43 110.772 -178.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -123.58 139.44 54.0 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.429 -0.582 . . . . 65.129999999999995 109.429 176.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.09 102.26 13.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.958 0.408 . . . . 72.430000000000007 110.703 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.1 p -81.43 -41.6 21.61 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.943 -0.571 . . . . 53.140000000000001 110.301 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.514 ' HA ' ' OE1' ' A' ' 38' ' ' GLU . 8.4 ptt85 -53.09 117.54 3.08 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.504 -0.771 . . . . 74.120000000000005 111.964 179.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.3 t -82.37 -179.25 7.35 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.872 -0.604 . . . . 65.349999999999994 110.639 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.09 -41.11 87.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 63.210000000000001 111.065 -178.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -61.03 -45.47 94.67 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.421 -0.354 . . . . 72.439999999999998 111.051 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 47.5 mt-10 -65.69 -41.62 92.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.06 -0.518 . . . . 74.109999999999999 110.434 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.436 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -65.5 -35.77 81.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.148 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.63 -44.49 93.46 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.083 0.468 . . . . 74.5 109.815 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -67.84 -36.59 80.61 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.84 -0.618 . . . . 62.100000000000001 110.208 178.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.8 mt -62.2 -42.01 98.89 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.321 -0.4 . . . . 75.019999999999996 110.048 178.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 39' ' ' ALA . 31.6 mm -54.8 -54.43 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 116.224 -0.444 . . . . 74.019999999999996 110.201 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -60.66 -38.35 84.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.771 -0.65 . . . . 71.310000000000002 110.373 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -46.92 93.53 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.859 -0.61 . . . . 64.439999999999998 111.882 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.485 ' O ' HG13 ' A' ' 50' ' ' ILE . 22.2 m-85 -61.39 -50.43 72.91 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.862 -0.422 . . . . 72.409999999999997 109.862 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -56.79 -48.94 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 115.816 -0.629 . . . . 52.310000000000002 111.165 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -39.61 89.3 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.257 -0.429 . . . . 70.129999999999995 111.27 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.48 ' HG3' ' OE1' ' A' ' 54' ' ' GLU . 41.9 tttp -67.27 -36.08 80.83 Favored 'General case' 0 C--O 1.239 0.528 0 CA-C-O 120.899 0.381 . . . . 64.310000000000002 110.73 -179.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.516 ' HA ' ' O ' ' A' ' 55' ' ' GLU . 91.4 mt -65.28 -47.05 88.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.552 -0.536 . . . . 71.439999999999998 109.552 176.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -68.77 -15.01 63.39 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.703 -0.681 . . . . 72.230000000000004 111.538 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.4 m -80.04 -11.77 59.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.952 0.406 . . . . 72.049999999999997 110.411 177.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 79.16 18.38 74.57 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.788 -0.72 . . . . 65.209999999999994 112.01 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE1' ' HG3' ' A' ' 49' ' ' LYS . 48.1 mt-10 -88.9 -68.35 0.78 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.107 0.479 . . . . 74.510000000000005 109.811 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 73.8 mm-40 -108.37 147.52 31.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.767 -0.652 . . . . 73.109999999999999 109.903 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -93.71 157.52 16.12 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.183 -0.673 . . . . 53.229999999999997 109.183 177.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -36.29 63.15 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.002 0.43 . . . . 64.150000000000006 110.814 -179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -60.76 -34.81 75.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.736 -0.665 . . . . 72.540000000000006 111.093 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.7 t -69.19 -44.76 71.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.171 0.51 . . . . 73.150000000000006 109.974 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.81 -45.81 80.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.741 -0.663 . . . . 61.530000000000001 110.531 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.605 ' HB1' ' HA3' ' A' ' 74' ' ' GLY . . . -70.24 -17.8 63.14 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.892 0.701 . . . . 43.310000000000002 112.892 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.7 m -99.01 -24.2 15.0 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.719 0.637 . . . . 64.019999999999996 112.719 -178.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -121.27 -28.3 4.71 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.136 0.791 . . . . 71.129999999999995 113.136 -176.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -105.81 5.2 30.6 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.114 0.413 . . . . 74.439999999999998 112.114 -175.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.7 t -90.97 140.63 29.66 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.654 -0.418 . . . . 71.450000000000003 109.946 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -88.8 -1.4 58.07 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.205 0.526 . . . . 64.420000000000002 110.559 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB2' HD23 ' A' ' 15' ' ' LEU . 46.9 t -87.5 154.57 20.53 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.956 -0.566 . . . . 53.299999999999997 110.474 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 m -74.87 -9.05 58.18 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.415 0.626 . . . . 74.310000000000002 109.882 177.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.9 p -74.2 -5.78 43.95 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.499 -0.773 . . . . 74.129999999999995 110.93 178.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.55 -29.0 68.87 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-N 116.041 -0.527 . . . . 44.030000000000001 109.99 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -68.98 -26.63 65.12 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.539 -0.755 . . . . 64.120000000000005 110.3 177.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -87.54 16.06 5.97 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.165 -0.471 . . . . 42.549999999999997 110.298 178.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 21.0 ttt85 69.0 17.53 8.57 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.601 -0.727 . . . . 75.549999999999997 110.434 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.605 ' HA3' ' HB1' ' A' ' 61' ' ' ALA . . . 69.31 29.27 71.94 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.613 -0.721 . . . . 61.119999999999997 113.137 178.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -124.94 135.31 52.71 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 122.614 -0.345 . . . . 74.120000000000005 110.943 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.509 ' HG ' ' CD2' ' A' ' 13' ' ' HIS . 75.5 mt -91.35 -11.22 38.53 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 71.209999999999994 111.302 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 75.77 -158.18 49.73 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.405 -0.902 . . . . 33.329999999999998 110.908 -176.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.9 117.44 27.9 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.84 0.352 . . . . 52.109999999999999 110.505 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -118.06 166.49 12.48 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 109.664 -0.495 . . . . 73.099999999999994 109.664 178.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.0 t -96.23 170.8 9.0 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.047 0.451 . . . . 72.219999999999999 111.243 -177.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -69.93 132.04 45.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.604 -0.725 . . . . 71.530000000000001 110.919 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.42 39.79 25.18 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.918 -0.658 . . . . 70.230000000000004 112.126 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -123.62 -4.69 8.19 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.158 0.429 . . . . 74.010000000000005 112.158 -176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 35.4 tpp -125.89 173.96 8.73 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.666 -0.414 . . . . 54.420000000000002 111.29 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -54.55 145.33 18.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.475 -0.33 . . . . 75.109999999999999 110.789 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 27.2 tptp -48.39 -54.46 25.7 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 113.457 0.91 . . . . 71.319999999999993 113.457 -176.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.411 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 29.4 Cg_endo -62.41 -26.79 76.9 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.12 1.88 . . . . 64.129999999999995 112.761 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -84.8 -43.23 14.39 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.144 0.497 . . . . 73.519999999999996 109.706 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.5 -50.98 70.19 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.063 -0.971 . . . . 73.329999999999998 110.922 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -63.18 -48.61 77.67 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.644 -0.707 . . . . 65.530000000000001 111.558 -178.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.72 77.03 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.186 -0.461 . . . . 72.099999999999994 112.043 -177.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.45 ' O ' ' HD2' ' A' ' 115' ' ' ARG . 71.7 m -59.04 -50.82 72.64 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.776 0.322 . . . . 63.450000000000003 111.459 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -79.2 -16.55 56.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.543 -0.299 . . . . 72.439999999999998 111.677 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -73.42 -29.44 62.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.159 0.504 . . . . 43.219999999999999 109.73 176.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.7 mt -84.71 -171.38 3.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.566 -0.743 . . . . 74.439999999999998 109.9 177.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -148.09 -178.88 6.53 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.178 -0.675 . . . . 75.129999999999995 109.178 177.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 116' ' ' THR . 32.5 m -54.53 113.04 1.14 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 122.595 0.358 . . . . 74.450000000000003 111.957 -178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 97.36 -6.56 63.45 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.935 -0.65 . . . . 61.039999999999999 113.621 175.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -90.99 149.7 21.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.146 0.498 . . . . 61.200000000000003 111.863 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 56.6 ttp -131.05 131.51 44.3 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.474 -0.785 . . . . 71.030000000000001 110.323 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 95' ' ' LEU . 28.2 t -87.21 168.29 13.35 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.685 -0.487 . . . . 74.209999999999994 109.685 179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.57 -137.28 5.86 Favored Glycine 0 N--CA 1.44 -1.067 0 C-N-CA 120.804 -0.712 . . . . 73.430000000000007 112.532 -179.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.21 108.95 2.83 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.728 2.285 . . . . 63.0 113.388 -178.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 74.4 t -102.97 104.79 17.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.258 -0.645 . . . . 54.039999999999999 109.258 175.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -76.11 122.88 24.93 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.262 -0.426 . . . . 75.319999999999993 111.445 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.517 HG22 ' H ' ' A' ' 107' ' ' ASP . 0.6 OUTLIER -127.42 -152.77 0.53 Allowed 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 116.137 -0.483 . . . . 61.439999999999998 109.99 -179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.517 ' H ' HG22 ' A' ' 106' ' ' THR . 8.7 m-20 -71.4 -65.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.947 0.351 . . . . 75.150000000000006 111.947 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 43.3 t -64.15 -42.92 96.58 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.113 -0.494 . . . . 72.349999999999994 111.729 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.4 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . -179.28 -145.02 6.05 Favored Glycine 0 N--CA 1.436 -1.312 0 C-N-CA 120.179 -1.01 . . . . 70.25 112.512 -178.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 33.8 mt -96.54 137.95 23.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 110.171 -0.307 . . . . 75.099999999999994 110.171 -178.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.543 ' CD2' HD13 ' A' ' 15' ' ' LEU . 12.7 m-70 -119.59 130.64 55.22 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.396 -0.365 . . . . 62.299999999999997 110.826 -179.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.672 HD12 HD23 ' A' ' 14' ' ' LEU . 24.6 mt -101.28 130.88 50.08 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 107.648 -1.242 . . . . 61.25 107.648 172.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 51.0 mt -113.0 120.24 62.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 N-CA-C 112.095 0.406 . . . . 74.540000000000006 112.095 -175.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.6 tp -112.84 109.53 19.06 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.971 -0.751 . . . . 73.230000000000004 108.971 176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.45 ' HD2' ' O ' ' A' ' 92' ' ' SER . 80.0 ttt180 -85.39 114.87 22.77 Favored 'General case' 0 C--N 1.312 -1.045 0 C-N-CA 120.584 -0.446 . . . . 73.230000000000004 110.793 -178.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.51 ' O ' HG23 ' A' ' 97' ' ' THR . 6.9 m -84.16 -44.65 13.77 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.913 -0.585 . . . . 73.439999999999998 110.425 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.429 ' HB2' ' H ' ' A' ' 10' ' ' ARG . 32.1 mm-40 . . . . . 0 C--O 1.243 0.726 0 CA-C-O 118.38 -0.819 . . . . 74.420000000000002 110.512 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.487 -0.645 . . . . 44.340000000000003 111.487 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.5 m -64.85 -30.11 71.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.053 0.454 . . . . 71.420000000000002 110.301 178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -102.95 154.06 19.6 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.36 -0.607 . . . . 75.420000000000002 109.36 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -102.35 153.11 20.32 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.862 -0.422 . . . . 63.399999999999999 109.862 179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -81.26 118.46 72.4 Favored Pre-proline 0 C--N 1.309 -1.162 0 N-CA-C 108.83 -0.804 . . . . 63.210000000000001 108.83 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -57.7 134.03 60.3 Favored 'Trans proline' 0 N--CA 1.466 -0.102 0 C-N-CA 122.865 2.377 . . . . 62.549999999999997 112.59 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -75.46 -26.3 58.14 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.951 -0.568 . . . . 54.229999999999997 109.571 177.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -125.73 113.42 17.3 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.473 -0.785 . . . . 73.430000000000007 109.418 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.8 m -111.83 148.4 15.04 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 CA-C-N 116.386 -0.37 . . . . 54.030000000000001 110.901 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 71.3 ttt180 -126.18 129.15 48.44 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.289 -0.414 . . . . 74.040000000000006 110.103 178.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.9 155.57 47.97 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.754 -0.657 . . . . 64.439999999999998 110.345 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.2 m -98.35 142.48 29.93 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 107.973 -1.121 . . . . 74.409999999999997 107.973 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.417 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 1.3 p80 -127.24 129.99 48.79 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.887 0.699 . . . . 71.319999999999993 112.887 -175.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.466 ' HB3' ' HB ' ' A' ' 112' ' ' ILE . 2.9 tm? -105.71 127.32 53.01 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 106.491 -1.67 . . . . 63.25 106.491 175.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.528 HD11 ' O ' ' A' ' 108' ' ' SER . 38.3 tp -125.56 121.08 32.62 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 120.641 -0.424 . . . . 65.340000000000003 111.286 -178.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 7.2 p -137.18 130.81 44.94 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.507 -0.769 . . . . 65.010000000000005 109.729 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 23' ' ' ARG . 51.0 mttp -97.16 -179.97 4.71 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-N 116.165 -0.471 . . . . 74.120000000000005 111.206 -179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.443 ' CE1' ' HB2' ' A' ' 20' ' ' GLN . 3.4 p80 -153.5 -179.26 7.6 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.447 -0.575 . . . . 65.120000000000005 109.447 -179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 p -48.13 -46.15 33.94 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 123.598 0.561 . . . . 75.140000000000001 111.843 -179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.443 ' HB2' ' CE1' ' A' ' 18' ' ' HIS . 78.5 mm-40 -85.34 69.1 10.68 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.113 0.483 . . . . 75.030000000000001 111.51 178.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.9 t -144.99 157.78 44.02 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.068 -0.716 . . . . 71.239999999999995 109.068 176.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.88 -19.54 60.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.94 0.4 . . . . 75.439999999999998 111.308 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.41 ' O ' ' HD3' ' A' ' 17' ' ' LYS . 32.6 tpt180 -123.78 94.94 45.28 Favored Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.31 -0.404 . . . . 75.239999999999995 110.321 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -91.53 28.4 0.38 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 123.083 2.522 . . . . 60.329999999999998 112.67 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.2 m -143.27 128.93 19.23 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.407 -0.36 . . . . 61.229999999999997 110.336 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.1 p -124.37 -168.72 1.85 Allowed 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 110.098 -0.334 . . . . 74.420000000000002 110.098 179.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 66.8 p-90 -86.26 -16.65 36.94 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.026 0.441 . . . . 73.109999999999999 110.006 177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -100.41 -37.95 8.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.014 -0.539 . . . . 71.310000000000002 110.809 -178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -131.94 117.36 18.34 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.489 -0.56 . . . . 71.209999999999994 109.489 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 63.229999999999997 111.888 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -134.24 101.18 4.92 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.045 0.45 . . . . 62.409999999999997 110.509 177.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.0 mm -71.18 93.17 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 CA-C-N 115.993 -0.549 . . . . 73.129999999999995 110.173 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.9 p -88.8 -16.88 30.98 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.049 -0.523 . . . . 74.430000000000007 111.608 -178.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -67.16 124.82 24.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.264 0.554 . . . . 71.310000000000002 111.815 -178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.2 t -84.28 -177.53 6.67 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.72 -0.673 . . . . 60.329999999999998 110.923 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -57.82 -42.02 83.44 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 122.794 0.438 . . . . 73.430000000000007 111.021 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.7 mm-40 -57.67 -44.17 85.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 111.328 -179.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 27.1 mm-40 -69.7 -42.16 74.44 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.878 -0.601 . . . . 70.530000000000001 110.449 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.51 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -62.01 -44.24 97.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.662 -0.699 . . . . 72.239999999999995 111.482 -179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -58.47 -45.47 88.55 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.538 -0.301 . . . . 61.32 111.609 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -61.44 -34.02 74.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.894 0.378 . . . . 75.219999999999999 110.816 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 89.9 mt -72.29 -41.81 66.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.015 -0.539 . . . . 74.409999999999997 110.019 178.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.51 HG12 ' O ' ' A' ' 39' ' ' ALA . 45.0 mm -58.65 -47.07 89.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-N 116.135 -0.484 . . . . 74.019999999999996 109.815 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.549 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 85.8 m-20 -57.48 -43.65 84.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 115.723 -0.672 . . . . 64.239999999999995 109.927 178.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.6 -41.28 97.24 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.722 -0.672 . . . . 74.230000000000004 112.243 179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -61.94 -48.83 78.67 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 109.518 -0.549 . . . . 71.530000000000001 109.518 178.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.83 -42.96 87.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.368 -0.833 . . . . 74.109999999999999 110.702 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 81.3 mm-40 -58.52 -48.06 82.1 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 116.299 -0.41 . . . . 73.409999999999997 110.902 178.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -59.54 -41.78 90.83 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 111.894 0.331 . . . . 42.039999999999999 111.894 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 71.9 mt -72.22 -41.47 66.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 74.120000000000005 111.844 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -78.11 -40.07 39.37 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.373 0.508 . . . . 72.030000000000001 112.373 -178.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.0 t -73.97 -26.3 60.4 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.596 0.236 . . . . 74.209999999999994 110.878 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.44 38.54 5.58 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.573 -0.822 . . . . 54.210000000000001 112.074 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -87.69 -49.55 7.07 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 72.099999999999994 110.226 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -143.38 173.7 11.39 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.787 -0.642 . . . . 63.109999999999999 110.305 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -99.15 153.97 18.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.136 -0.484 . . . . 71.040000000000006 110.215 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -55.52 -38.16 68.86 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.005 0.431 . . . . 54.409999999999997 110.264 179.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.509 ' OE2' ' HD2' ' A' ' 73' ' ' ARG . 35.5 mt-10 -61.68 -30.67 70.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.644 -0.707 . . . . 72.450000000000003 111.283 -179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.8 t -76.67 -28.93 56.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.347 0.594 . . . . 74.510000000000005 110.453 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -87.84 -47.94 8.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.781 -0.645 . . . . 64.310000000000002 111.081 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -19.98 64.03 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.925 0.713 . . . . 71.120000000000005 112.925 -176.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.686 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 2.7 p -76.65 -20.79 56.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 113.196 0.813 . . . . 72.319999999999993 113.196 -177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -128.77 -22.53 3.24 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.931 0.715 . . . . 74.519999999999996 112.931 -179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -91.56 -10.85 39.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 112.658 0.614 . . . . 72.420000000000002 112.658 -177.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 34.3 m -84.41 136.21 33.96 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.998 -0.281 . . . . 61.299999999999997 110.244 177.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -84.96 -11.8 54.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.306 0.574 . . . . 53.020000000000003 109.913 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.466 ' HB2' HD23 ' A' ' 15' ' ' LEU . 30.9 t -79.6 159.7 26.7 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.317 -0.856 . . . . 74.019999999999996 110.89 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 17.0 m -70.05 -19.0 63.31 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.161 -0.472 . . . . 64.549999999999997 110.138 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 34.9 m -67.67 -5.03 13.87 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.969 -0.56 . . . . 64.129999999999995 111.421 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' ' 62' ' ' SER . . . -51.99 -51.15 59.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.185 -0.461 . . . . 74.319999999999993 111.285 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -76.88 4.44 9.83 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.116 0.413 . . . . 64.049999999999997 112.116 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -100.3 12.34 37.33 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.964 -0.754 . . . . 71.319999999999993 108.964 175.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.509 ' HD2' ' OE2' ' A' ' 58' ' ' GLU . 75.9 mtm180 69.33 16.4 8.36 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.791 179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.49 3.43 90.53 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.002 -0.618 . . . . 70.420000000000002 113.316 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -73.72 134.6 43.54 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.085 0.469 . . . . 71.430000000000007 111.025 -179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.518 ' O ' HD23 ' A' ' 76' ' ' LEU . 4.1 tt -101.69 -19.64 15.32 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.782 -0.821 . . . . 75.030000000000001 108.782 178.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.44 -176.38 48.2 Favored Glycine 0 N--CA 1.437 -1.272 0 CA-C-N 115.56 -0.745 . . . . 63.130000000000003 111.628 -178.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -88.04 131.98 34.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 120.748 0.309 . . . . 75.200000000000003 110.235 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.1 p90 -133.27 154.44 50.68 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.913 -0.585 . . . . 72.340000000000003 110.02 178.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 p -95.56 -80.85 0.41 Allowed 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 111.989 0.366 . . . . 72.310000000000002 111.989 -177.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 9.8 ptm85 -161.64 136.97 7.51 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 72.310000000000002 110.842 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.57 15.93 76.87 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 115.748 -0.66 . . . . 74.310000000000002 111.474 -179.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -103.87 -36.38 7.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.884 0.373 . . . . 71.450000000000003 110.824 -176.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 26.5 tpp -121.23 157.56 30.01 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.205 -0.452 . . . . 72.129999999999995 109.996 -179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -48.03 135.7 12.43 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 123.38 0.425 . . . . 73.409999999999997 111.464 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.499 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 12.7 tmtt? -48.6 -52.48 44.11 Favored Pre-proline 0 CA--C 1.55 0.966 0 CA-C-N 115.64 -0.709 . . . . 50.240000000000002 112.635 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 11.1 Cg_endo -53.54 -24.14 27.78 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 122.619 2.212 . . . . 50.119999999999997 113.413 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.561 ' CD2' HG12 ' A' ' 113' ' ' ILE . 31.1 t80 -99.42 -53.36 3.24 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.056 0.455 . . . . 74.319999999999993 110.586 -179.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -59.86 -48.08 83.13 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.52 -0.764 . . . . 60.530000000000001 111.386 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -60.76 -45.09 95.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.115 -0.493 . . . . 73.420000000000002 111.683 -178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.92 66.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 51.520000000000003 111.351 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -65.84 -24.16 66.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.237 -0.438 . . . . 45.520000000000003 111.668 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -81.84 -27.51 33.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.412 . . . . 73.019999999999996 110.542 178.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -80.61 -28.08 37.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.863 -0.608 . . . . 73.450000000000003 110.887 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.41 HD11 ' HB2' ' A' ' 101' ' ' SER . 94.8 mt -82.68 133.22 35.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.067 -0.515 . . . . 74.120000000000005 110.546 179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -97.09 169.41 9.83 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 116.322 -0.399 . . . . 64.030000000000001 109.97 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 27.9 m -55.89 111.28 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.302 -0.408 . . . . 62.039999999999999 111.158 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.31 -13.28 23.54 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.692 -0.766 . . . . 42.210000000000001 112.691 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -91.0 154.63 19.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.908 0.385 . . . . 72.200000000000003 110.958 -179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 60.8 ttp -142.23 130.23 21.91 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.127 -0.488 . . . . 74.109999999999999 110.427 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.41 ' HB2' HD11 ' A' ' 95' ' ' LEU . 38.0 t -78.86 157.46 28.32 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 116.075 -0.512 . . . . 73.400000000000006 110.321 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.18 -155.88 22.78 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.811 -0.709 . . . . 72.099999999999994 111.776 178.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.02 105.73 1.41 Allowed 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.636 2.224 . . . . 74.439999999999998 113.232 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.9 t -89.2 110.8 21.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 108.921 -0.77 . . . . 74.239999999999995 108.921 175.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -83.92 122.47 28.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.214 -0.448 . . . . 63.520000000000003 111.937 -176.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.5 p -142.45 178.57 7.51 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.793 -0.639 . . . . 73.549999999999997 109.779 178.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -69.21 -31.98 70.94 Favored 'General case' 0 CA--C 1.509 -0.617 0 CA-C-O 121.036 0.446 . . . . 73.549999999999997 110.865 179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.528 ' O ' HD11 ' A' ' 15' ' ' LEU . 11.8 p -79.74 4.97 14.66 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.63 -0.713 . . . . 75.239999999999995 111.33 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 112.85 -158.44 14.28 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 120.845 -0.693 . . . . 70.010000000000005 112.389 178.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 66.4 mt -97.93 128.12 49.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 N-CA-C 109.837 -0.431 . . . . 74.230000000000004 109.837 179.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -110.9 125.54 53.76 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.496 -0.32 . . . . 75.239999999999995 110.812 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.466 ' HB ' ' HB3' ' A' ' 14' ' ' LEU . 59.0 mt -102.17 130.67 51.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 108.458 -0.942 . . . . 54.140000000000001 108.458 174.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.561 HG12 ' CD2' ' A' ' 88' ' ' PHE . 11.0 mt -110.79 107.43 22.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.652 -0.249 . . . . 73.010000000000005 111.202 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.9 tt -104.75 114.81 29.25 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.174 -0.676 . . . . 71.439999999999998 109.174 177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.6 tpt85 -79.39 108.39 12.88 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.222 -0.444 . . . . 71.510000000000005 110.261 -177.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 5.2 p -95.07 -64.07 1.1 Allowed 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.644 0.979 . . . . 75.530000000000001 113.644 -176.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 . . . . . 0 C--O 1.246 0.872 0 CA-C-O 118.344 -0.836 . . . . 74.420000000000002 111.765 -174.901 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.543 0 N-CA-C 112.216 -0.354 . . . . 44.140000000000001 112.216 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.1 t -62.78 112.48 2.55 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 122.489 0.316 . . . . 72.239999999999995 110.322 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -71.43 144.11 49.87 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 120.811 -0.356 . . . . 73.319999999999993 110.265 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.02 175.73 10.12 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 116.073 -0.512 . . . . 64.400000000000006 110.025 179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -91.53 107.57 22.92 Favored Pre-proline 0 C--N 1.32 -0.712 0 N-CA-C 108.559 -0.904 . . . . 53.299999999999997 108.559 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -71.77 139.37 33.5 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.564 2.176 . . . . 73.349999999999994 112.669 -176.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.07 -16.63 37.48 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.292 0.568 . . . . 70.340000000000003 109.877 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.472 ' HA ' ' O ' ' A' ' 79' ' ' PHE . 99.6 mtt180 -107.07 117.51 34.26 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.257 -0.883 . . . . 74.239999999999995 110.021 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.3 m -124.54 148.66 28.79 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.178 0 CA-C-N 116.165 -0.471 . . . . 73.239999999999995 110.366 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 77' ' ' GLY . 79.4 ttt180 -103.54 109.06 20.58 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 110.043 -0.355 . . . . 70.120000000000005 110.043 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.8 m -128.88 132.78 47.74 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-O 121.299 0.571 . . . . 74.140000000000001 111.318 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.411 ' HA ' ' HA ' ' A' ' 75' ' ' ASP . 6.8 m -98.1 142.77 29.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 108.247 -1.02 . . . . 54.520000000000003 108.247 176.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.493 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.5 OUTLIER -133.91 129.06 35.8 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.452 0.908 . . . . 64.349999999999994 113.452 -176.58 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.543 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.4 tt -106.78 142.61 36.15 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 107.645 -1.243 . . . . 75.239999999999995 107.645 174.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.545 HD23 ' HB2' ' A' ' 67' ' ' SER . 46.0 tp -123.75 134.05 53.74 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.883 0.327 . . . . 75.530000000000001 111.883 -178.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.414 ' HA ' ' OD2' ' A' ' 66' ' ' ASP . 14.4 p -117.64 132.62 66.93 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-N 115.758 -0.655 . . . . 70.129999999999995 109.944 175.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.89 158.24 16.88 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.956 0.408 . . . . 73.340000000000003 110.171 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -139.98 158.25 44.36 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.11 -0.496 . . . . 75.120000000000005 109.735 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 34.2 t -43.76 -59.88 2.04 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 123.98 0.8 . . . . 74.430000000000007 112.356 -177.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -92.02 66.84 5.04 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.053 0.454 . . . . 71.340000000000003 111.12 -178.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 t -116.0 173.74 6.41 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.067 -0.515 . . . . 75.099999999999994 109.621 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -56.51 -57.21 13.3 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.251 -0.431 . . . . 53.299999999999997 109.879 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -126.55 97.96 32.69 Favored Pre-proline 0 C--N 1.317 -0.807 0 N-CA-C 109.37 -0.604 . . . . 72.549999999999997 109.37 175.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 8.7 Cg_exo -73.73 50.57 2.09 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.387 2.725 . . . . 60.299999999999997 112.295 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.5 m -140.82 152.39 45.13 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 116.038 -0.528 . . . . 53.219999999999999 110.172 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 82.3 p -154.99 -176.4 5.92 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.358 -0.608 . . . . 60.350000000000001 109.358 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 51.5 p-90 -82.64 -3.38 56.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.352 0.596 . . . . 72.329999999999998 109.589 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.452 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 58.9 mtp180 -104.99 -43.64 5.01 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.791 . . . . 74.219999999999999 110.078 -178.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.448 ' HB3' HD13 ' A' ' 32' ' ' ILE . 62.8 tt0 -142.92 118.34 10.29 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.866 -0.606 . . . . 74.230000000000004 109.894 -178.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -72.36 -29.27 63.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.926 0.393 . . . . 70.25 111.164 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.1 ptpt -123.1 94.11 4.16 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.232 0.539 . . . . 74.519999999999996 110.241 178.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 29' ' ' GLN . 42.6 mm -68.73 104.01 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 115.501 -0.772 . . . . 53.140000000000001 111.39 -178.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.54 -24.07 20.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.044 -0.525 . . . . 74.209999999999994 111.001 177.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HG2' ' H ' ' A' ' 34' ' ' ARG . 4.5 ptt180 -60.64 118.22 6.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.898 -0.592 . . . . 75.400000000000006 110.303 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.4 t -85.15 -174.72 5.4 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.767 -0.651 . . . . 74.530000000000001 112.098 -175.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -57.58 -50.62 72.52 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.559 -0.746 . . . . 70.019999999999996 111.482 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -52.2 -44.01 64.5 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.207 -0.451 . . . . 65.549999999999997 111.295 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.562 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 38.8 mt-10 -67.55 -51.14 54.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.9 -0.591 . . . . 72.140000000000001 110.694 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.1 80.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.02 -0.536 . . . . 51.219999999999999 111.145 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.0 tp -61.93 -44.3 97.05 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.856 -0.611 . . . . 71.109999999999999 110.722 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -70.27 -33.82 72.04 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.416 -0.356 . . . . 71.150000000000006 111.097 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.6 mt -62.3 -48.35 80.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.988 -0.375 . . . . 72.209999999999994 109.988 177.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.468 HG23 HG12 ' A' ' 112' ' ' ILE . 29.6 mm -54.08 -60.49 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 CA-C-N 115.772 -0.649 . . . . 73.230000000000004 111.302 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -63.8 -28.91 70.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.313 -0.403 . . . . 74.209999999999994 111.0 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.479 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -64.43 -54.72 27.58 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 111.609 -0.597 . . . . 70.219999999999999 111.609 178.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.46 ' O ' HG13 ' A' ' 50' ' ' ILE . 26.3 m-85 -56.73 -45.15 82.13 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.005 -0.368 . . . . 72.230000000000004 110.005 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.465 ' CD1' ' HA2' ' A' ' 102' ' ' GLY . 78.6 mt -54.98 -47.76 76.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-N 115.798 -0.637 . . . . 51.149999999999999 110.843 178.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -64.61 -40.13 94.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.26 -0.427 . . . . 63.409999999999997 110.756 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 28.3 mtpp -64.39 -39.83 94.63 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.96 0.409 . . . . 74.200000000000003 110.692 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 46' ' ' TYR . 88.4 mt -68.87 -46.91 78.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.21 -0.45 . . . . 74.129999999999995 110.637 178.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.8 mtpt -62.17 -29.08 70.11 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.307 -0.406 . . . . 72.540000000000006 112.04 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 19.3 m -77.41 -9.04 58.63 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.828 0.347 . . . . 72.120000000000005 110.76 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 3.33 83.35 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.002 -0.618 . . . . 75.329999999999998 112.288 179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -73.78 -62.54 1.46 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.992 0.425 . . . . 63.43 110.783 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.449 ' HG3' ' HE3' ' A' ' 49' ' ' LYS . 24.3 mm-40 -101.92 167.15 10.24 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.066 -0.516 . . . . 72.109999999999999 110.682 -178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -119.66 140.41 50.67 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.531 -0.544 . . . . 53.450000000000003 109.531 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -57.32 -55.6 32.66 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.8 0.296 . . . . 63.43 111.8 -177.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.405 ' OE2' ' HD3' ' A' ' 73' ' ' ARG . 47.8 mt-10 -53.14 -42.52 66.16 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.686 0.279 . . . . 75.310000000000002 111.351 -179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 14.6 m -64.39 -47.28 79.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.294 -0.412 . . . . 72.349999999999994 110.93 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 82.2 mt -67.89 -43.29 79.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.389 -0.369 . . . . 74.120000000000005 111.016 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.618 ' O ' ' HA ' ' A' ' 70' ' ' ALA . . . -68.53 -10.85 58.31 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.142 -0.481 . . . . 75.219999999999999 112.273 -177.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.481 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 70.5 m -88.38 -13.19 41.19 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.775 0.322 . . . . 75.450000000000003 111.267 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -128.62 -36.41 1.85 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.7 0.63 . . . . 64.519999999999996 112.7 -177.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -93.81 9.1 38.59 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.4 0.518 . . . . 73.5 112.4 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 68.2 m -92.09 114.45 26.99 Favored 'General case' 0 C--N 1.314 -0.935 0 C-N-CA 120.708 -0.397 . . . . 65.310000000000002 110.06 177.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.452 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 59.5 m-20 -78.76 51.3 1.08 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.256 0.55 . . . . 61.350000000000001 110.781 -179.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.545 ' HB2' HD23 ' A' ' 15' ' ' LEU . 26.0 t -164.61 178.19 7.51 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.676 -0.693 . . . . 71.239999999999995 109.355 -178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 50.0 m -67.06 -14.06 62.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.97 0.414 . . . . 51.43 110.713 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.5 m -56.11 -24.77 42.62 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.738 -0.665 . . . . 75.010000000000005 111.024 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.618 ' HA ' ' O ' ' A' ' 61' ' ' ALA . . . -61.11 -30.29 70.27 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 115.923 -0.58 . . . . 62.350000000000001 111.725 -179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -83.44 -11.46 57.5 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.063 0.459 . . . . 71.109999999999999 111.043 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -113.48 13.81 18.94 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.205 -0.452 . . . . 70.439999999999998 111.248 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.405 ' HD3' ' OE2' ' A' ' 58' ' ' GLU . 83.2 mtt180 64.03 11.19 5.94 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.305 -0.407 . . . . 75.239999999999995 111.724 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.401 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.39 -25.08 3.35 Favored Glycine 0 CA--C 1.525 0.667 0 C-N-CA 121.053 -0.594 . . . . 62.450000000000003 112.606 -178.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 12' ' ' SER . 13.0 t0 -77.91 126.61 31.11 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.063 0.459 . . . . 75.219999999999999 111.421 -178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.2 mt -103.42 -4.75 23.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.726 -0.67 . . . . 70.349999999999994 110.776 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' A' ' 10' ' ' ARG . . . 78.13 -165.32 51.96 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.194 -1.003 . . . . 70.349999999999994 110.924 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.22 119.26 22.75 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.877 -0.416 . . . . 72.310000000000002 109.877 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 29.4 p90 -127.4 162.7 25.7 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.229 -0.442 . . . . 72.519999999999996 110.83 -178.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.9 t -82.94 135.63 34.83 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.93 -0.577 . . . . 73.310000000000002 109.816 177.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.401 ' HD3' ' CZ ' ' A' ' 93' ' ' PHE . 31.0 ptt180 -57.35 -31.49 65.79 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.898 -0.592 . . . . 74.019999999999996 111.939 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -67.11 -23.82 73.1 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.662 -0.78 . . . . 53.049999999999997 112.222 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.6 16.37 17.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.957 0.408 . . . . 71.540000000000006 109.966 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 42.2 tpp -130.39 154.18 47.96 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.04 -0.527 . . . . 73.430000000000007 110.635 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.403 ' OE1' ' HA ' ' A' ' 85' ' ' GLN . 16.0 mm-40 -60.46 144.26 51.58 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.529 -0.305 . . . . 62.32 110.566 179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.477 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 48.2 tptt -59.46 -50.4 87.43 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 113.093 0.775 . . . . 72.230000000000004 113.093 -176.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 16.9 Cg_endo -58.76 -35.43 98.64 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 121.79 1.66 . . . . 75.209999999999994 111.445 178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -68.57 -44.37 74.57 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.582 -0.736 . . . . 73.430000000000007 109.174 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -58.46 -48.59 80.26 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.605 -0.725 . . . . 71.400000000000006 110.158 177.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -55.58 -42.77 75.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.503 -0.771 . . . . 63.039999999999999 111.4 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -70.99 -40.7 71.73 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.327 -0.397 . . . . 71.150000000000006 110.91 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 52.9 m -62.87 -45.22 93.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.039 0.447 . . . . 63.530000000000001 111.328 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.401 ' CZ ' ' HD3' ' A' ' 81' ' ' ARG . 13.1 m-85 -78.65 -6.24 55.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.098 -0.501 . . . . 74.510000000000005 111.587 -178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -88.67 -26.3 21.92 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.252 -0.647 . . . . 74.319999999999993 109.252 175.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.454 HD11 ' HB2' ' A' ' 101' ' ' SER . 91.0 mt -86.43 179.71 6.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.195 -0.911 . . . . 73.329999999999998 110.787 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -130.21 176.65 7.93 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.548 -0.751 . . . . 74.239999999999995 109.542 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.4 m -61.05 110.16 1.28 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.012 0.434 . . . . 64.450000000000003 111.035 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 98.39 16.22 32.74 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 121.023 -0.608 . . . . 55.409999999999997 112.502 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -109.72 148.17 31.88 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.849 0.357 . . . . 72.439999999999998 111.237 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 40.3 ttp -128.63 127.96 43.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.027 -0.533 . . . . 65.040000000000006 110.473 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.454 ' HB2' HD11 ' A' ' 95' ' ' LEU . 32.1 t -83.05 161.42 21.69 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.031 -0.531 . . . . 63.25 110.823 -178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.465 ' HA2' ' CD1' ' A' ' 47' ' ' ILE . . . -84.98 -139.02 4.47 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 115.938 -0.574 . . . . 44.229999999999997 112.405 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -65.58 106.15 0.85 Allowed 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.821 2.347 . . . . 72.109999999999999 112.665 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 51.9 t -111.96 123.24 67.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 116.138 -0.483 . . . . 61.200000000000003 110.483 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -97.12 124.75 41.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.2 -0.455 . . . . 71.010000000000005 109.872 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.2 p -113.5 -60.56 1.87 Allowed 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 112.364 0.505 . . . . 51.210000000000001 112.364 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -144.57 -53.01 0.31 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.382 0.512 . . . . 71.310000000000002 112.382 -175.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 18.9 m -113.53 -53.67 2.67 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.944 0.35 . . . . 74.230000000000004 111.944 -176.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -128.38 -169.38 12.61 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 119.973 -1.108 . . . . 63.049999999999997 112.733 -177.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 27.7 mt -90.78 138.49 19.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.501 -0.555 . . . . 73.129999999999995 109.501 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.543 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 72.9 m-70 -119.89 145.31 46.81 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.765 0.317 . . . . 61.140000000000001 111.373 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 50.0 mt -100.95 117.35 46.06 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 107.469 -1.308 . . . . 74.109999999999999 107.469 173.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 62.6 mt -103.72 110.9 31.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 120.92 0.39 . . . . 73.510000000000005 111.724 -176.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 44.8 tp -106.09 107.4 18.38 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.815 -0.63 . . . . 72.430000000000007 109.842 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -85.19 100.22 11.61 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.686 -0.487 . . . . 74.129999999999995 109.686 178.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.2 m -74.15 -38.18 63.8 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.686 -0.688 . . . . 74.239999999999995 110.56 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 . . . . . 0 C--O 1.257 1.447 0 CA-C-O 118.518 -0.753 . . . . 73.209999999999994 110.318 -178.714 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.021 -0.432 . . . . 45.030000000000001 112.021 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.5 m -79.26 159.45 27.26 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 110.128 -0.323 . . . . 64.150000000000006 110.128 179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -68.19 -39.53 82.44 Favored 'General case' 0 CA--C 1.513 -0.468 0 N-CA-C 109.63 -0.508 . . . . 75.420000000000002 109.63 178.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 59.4 ttp -96.43 88.56 4.76 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.216 -1.031 . . . . 62.340000000000003 108.216 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -126.3 118.49 23.35 Favored Pre-proline 0 C--N 1.312 -1.022 0 CA-C-N 116.018 -0.537 . . . . 72.530000000000001 110.679 -176.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.55 133.2 50.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.775 2.317 . . . . 74.219999999999999 111.895 178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.27 -24.73 25.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.89 -0.596 . . . . 63.340000000000003 110.214 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -113.24 127.04 56.04 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.602 -0.727 . . . . 72.019999999999996 109.784 178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 29.1 m -125.58 143.65 38.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 CA-C-N 116.263 -0.426 . . . . 72.340000000000003 110.514 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' HB3' ' HB2' ' A' ' 117' ' ' GLU . 60.6 ttt180 -112.27 122.92 49.08 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.623 -0.51 . . . . 55.119999999999997 109.623 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.5 m -134.53 167.64 20.42 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 121.101 0.476 . . . . 52.530000000000001 111.049 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -122.37 145.33 48.37 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.486 -0.931 . . . . 53.119999999999997 108.486 176.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.426 ' HD2' ' O ' ' A' ' 74' ' ' GLY . 1.6 p80 -124.06 129.44 50.9 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.448 -0.501 . . . . 74.140000000000001 112.304 -176.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.652 HD23 HD12 ' A' ' 112' ' ' ILE . 38.4 tp -106.2 119.11 38.37 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 108.506 -0.924 . . . . 74.219999999999999 108.506 176.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.62 HD13 ' NE2' ' A' ' 111' ' ' HIS . 13.8 tp -116.84 120.17 37.68 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.15 0.5 . . . . 63.020000000000003 111.326 -178.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 57.7 t -118.47 105.92 18.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-N 115.0 -1.0 . . . . 74.140000000000001 108.312 175.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -76.48 168.85 19.34 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.497 0.665 . . . . 73.200000000000003 111.803 -177.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.437 ' NE2' ' HA2' ' A' ' 109' ' ' GLY . 2.0 p80 -139.26 156.26 47.19 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.134 -0.939 . . . . 64.409999999999997 109.828 -178.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.7 p -51.34 -38.02 50.93 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 123.834 0.709 . . . . 72.209999999999994 112.059 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -74.05 29.96 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.659 0.614 . . . . 73.409999999999997 112.659 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.4 t -113.16 179.42 3.97 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.972 -0.751 . . . . 75.319999999999993 108.972 177.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.416 HH12 ' HB2' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -83.27 -29.4 28.42 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.933 0.397 . . . . 71.340000000000003 110.364 -179.733 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -111.19 102.0 51.79 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.098 -0.501 . . . . 74.209999999999994 110.43 -179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.446 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 66.1 Cg_endo -92.03 34.26 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.998 2.465 . . . . 74.129999999999995 111.712 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.5 p -149.76 158.07 43.82 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.925 0.393 . . . . 74.430000000000007 111.054 -178.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 95.9 p -148.27 -161.6 1.37 Allowed 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.99 -0.55 . . . . 72.409999999999997 109.667 178.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 70.2 p-90 -89.76 -5.58 56.82 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.916 0.389 . . . . 72.129999999999995 110.584 178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -130.71 0.13 4.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.255 -0.43 . . . . 63.329999999999998 111.73 -177.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -148.36 128.72 13.88 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.697 -0.483 . . . . 70.430000000000007 109.697 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.7 -31.34 32.2 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.495 -0.321 . . . . 75.140000000000001 111.068 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' PRO . 20.9 ptmt -140.57 106.93 5.26 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.391 0.615 . . . . 73.549999999999997 111.551 178.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 40.6 mm -67.79 102.27 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.825 -0.805 . . . . 63.049999999999997 108.825 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 m -97.68 -11.44 23.5 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.92 -0.582 . . . . 70.239999999999995 110.674 -177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -74.7 129.41 37.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.021 -0.536 . . . . 74.099999999999994 110.287 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.477 HG22 ' OE1' ' A' ' 38' ' ' GLU . 9.0 t -87.24 -178.66 6.26 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 120.759 -0.376 . . . . 62.340000000000003 110.027 178.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -62.87 -44.46 96.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.841 -0.163 . . . . 61.32 111.426 -177.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.52 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 1.7 mp0 -57.04 -44.18 82.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.416 -0.356 . . . . 72.120000000000005 110.567 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.477 ' OE1' HG22 ' A' ' 35' ' ' THR . 42.1 mt-10 -66.97 -43.87 81.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.847 -0.615 . . . . 55.340000000000003 110.727 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.568 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.49 -41.21 98.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.015 -0.539 . . . . 74.120000000000005 110.584 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -59.86 -42.1 92.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.903 -0.59 . . . . 75.209999999999994 110.05 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 37' ' ' GLU . 50.3 mm-40 -58.39 -41.57 85.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.08 -0.509 . . . . 73.129999999999995 110.474 178.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.0 mt -67.04 -40.73 87.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.856 -0.611 . . . . 52.119999999999997 110.036 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.568 HG12 ' O ' ' A' ' 39' ' ' ALA . 39.5 mm -53.55 -49.47 55.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 CA-C-N 115.674 -0.694 . . . . 61.109999999999999 111.066 179.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -55.23 -47.07 75.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.162 0.506 . . . . 73.329999999999998 110.191 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 49' ' ' LYS . . . -57.33 -47.29 89.04 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.437 -0.801 . . . . 51.229999999999997 112.257 179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.467 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.3 m-85 -59.94 -52.3 66.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.347 0.118 . . . . 74.099999999999994 110.948 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 71.5 mt -56.22 -45.95 81.21 Favored 'Isoleucine or valine' 0 C--O 1.24 0.557 0 CA-C-O 121.023 0.439 . . . . 75.319999999999993 110.705 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -66.21 -42.01 89.35 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.887 -0.597 . . . . 75.409999999999997 112.142 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 45' ' ' GLY . 30.0 mtpp -63.58 -37.98 89.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.621 0.248 . . . . 64.150000000000006 111.491 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 46' ' ' TYR . 79.0 mt -66.33 -48.16 81.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.39 -0.368 . . . . 55.43 110.718 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -69.98 -18.49 63.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.345 -0.389 . . . . 63.5 111.924 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 27.3 m -91.12 1.05 57.38 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.912 0.387 . . . . 71.230000000000004 110.741 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.08 30.27 69.98 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.999 -0.546 . . . . 75.120000000000005 113.363 177.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -92.11 -53.13 4.38 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 122.506 -0.408 . . . . 72.319999999999993 110.655 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.404 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 39.3 mt-10 -137.1 148.02 46.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.08 -0.509 . . . . 74.209999999999994 110.077 178.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.3 m-20 -81.89 160.82 23.34 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.149 -0.478 . . . . 73.099999999999994 111.093 -179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -62.81 -53.9 47.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.935 -0.575 . . . . 75.030000000000001 110.582 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 73' ' ' ARG . 2.8 mp0 -58.45 -31.24 67.6 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.176 0.512 . . . . 65.120000000000005 110.509 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 29.7 t -67.23 -52.07 45.54 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.758 -0.656 . . . . 63.310000000000002 109.652 178.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 96.1 mt -64.24 -33.88 76.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.398 -0.365 . . . . 73.409999999999997 110.858 179.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.486 ' HA ' ' CD1' ' A' ' 14' ' ' LEU . . . -63.89 -32.44 73.96 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.033 -0.53 . . . . 75.030000000000001 111.46 179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.9 p -95.76 5.72 50.68 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.987 0.423 . . . . 73.510000000000005 111.225 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' SER . 27.8 mt-30 -115.43 -53.96 2.57 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.193 0.442 . . . . 64.129999999999995 112.193 -179.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -108.88 -6.76 15.64 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.661 0.986 . . . . 43.539999999999999 113.661 -173.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.445 ' HB2' HD12 ' A' ' 14' ' ' LEU . 11.7 t -78.83 136.92 37.47 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.022 -0.671 . . . . 61.219999999999999 110.599 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -95.63 11.61 32.66 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.847 -0.615 . . . . 75.329999999999998 110.367 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.539 ' HB2' ' HB3' ' A' ' 15' ' ' LEU . 48.3 t -81.81 145.2 30.55 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.699 -0.682 . . . . 63.439999999999998 110.146 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 p -62.4 -26.3 68.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.073 0.463 . . . . 54.020000000000003 110.983 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.5 m -74.94 -4.99 41.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.73 -0.668 . . . . 65.150000000000006 111.81 -178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.7 -32.06 65.09 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.815 0.34 . . . . 71.430000000000007 111.187 179.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -32.63 74.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.231 0.539 . . . . 74.329999999999998 110.624 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.33 16.36 11.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.849 -0.614 . . . . 73.109999999999999 110.19 178.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.493 ' HB3' ' HB3' ' A' ' 58' ' ' GLU . 12.3 mpt_? 67.45 14.16 9.54 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.402 -0.817 . . . . 73.349999999999994 111.94 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.426 ' O ' ' HD2' ' A' ' 13' ' ' HIS . . . 80.35 7.65 88.34 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.738 -0.744 . . . . 44.020000000000003 112.806 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -80.02 136.95 36.7 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.828 0.347 . . . . 61.229999999999997 110.843 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 5.7 mp -101.49 -21.2 14.82 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.161 -0.472 . . . . 43.200000000000003 110.109 178.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 86.96 -171.04 42.3 Favored Glycine 0 N--CA 1.438 -1.19 0 N-CA-C 110.772 -0.931 . . . . 42.009999999999998 110.772 -176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -78.05 107.93 10.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 117.187 0.494 . . . . 64.239999999999995 110.182 179.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.0 p90 -123.59 -174.37 2.95 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.192 -0.458 . . . . 72.099999999999994 110.756 -178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.3 t -148.87 -165.89 2.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.247 -0.649 . . . . 72.010000000000005 109.247 179.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -66.63 134.43 52.28 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.033 0.444 . . . . 73.530000000000001 111.769 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.447 ' H ' ' CD ' ' A' ' 89' ' ' GLU . . . 102.91 22.91 8.97 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.878 -0.601 . . . . 61.340000000000003 112.375 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -122.99 -34.81 3.11 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.33 0.493 . . . . 54.509999999999998 112.33 -177.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 44.1 tpp -135.73 171.33 14.61 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.812 -0.355 . . . . 53.030000000000001 111.207 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -55.58 141.61 36.7 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 116.315 -0.402 . . . . 72.420000000000002 110.273 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.407 ' HB3' ' HD3' ' A' ' 87' ' ' PRO . 86.4 tttt -51.96 -48.57 87.76 Favored Pre-proline 0 CA--C 1.549 0.942 0 N-CA-C 113.195 0.813 . . . . 71.019999999999996 113.195 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' HD3' ' HB3' ' A' ' 86' ' ' LYS . 73.3 Cg_exo -51.51 -28.79 29.53 Favored 'Trans proline' 0 C--N 1.373 1.838 0 C-N-CA 122.209 1.939 . . . . 71.439999999999998 113.03 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CD2' HG12 ' A' ' 113' ' ' ILE . 48.1 t80 -95.48 -49.88 5.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.324 0.583 . . . . 74.450000000000003 110.387 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLY . 34.7 tt0 -61.21 -50.22 73.96 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.324 -0.853 . . . . 63.009999999999998 111.557 -176.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -63.48 -39.64 95.0 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.899 0.381 . . . . 65.099999999999994 111.05 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.61 -32.26 73.84 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.863 -0.608 . . . . 54.539999999999999 111.231 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.5 m -60.19 -31.77 70.45 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.177 -0.465 . . . . 72.310000000000002 111.294 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -86.81 -19.49 28.93 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.26 -0.427 . . . . 74.219999999999999 110.526 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -83.93 -42.93 15.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.086 -0.506 . . . . 74.129999999999995 111.395 -178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.5 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 69.8 mt -81.79 145.08 30.64 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.058 -0.519 . . . . 74.25 110.334 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.517 ' CG ' ' HG2' ' A' ' 99' ' ' GLU . 28.7 ptt180 -80.66 176.9 9.39 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 109.814 -0.439 . . . . 74.439999999999998 109.814 178.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.7 m -66.71 114.43 5.6 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.131 -0.486 . . . . 62.210000000000001 110.821 178.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.39 6.8 38.33 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.504 -0.855 . . . . 61.109999999999999 113.814 178.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.517 ' HG2' ' CG ' ' A' ' 96' ' ' ARG . 63.1 mm-40 -88.32 141.17 28.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.387 0.594 . . . . 73.129999999999995 111.905 179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 53.9 tpp -104.44 128.47 52.34 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.163 -0.926 . . . . 74.010000000000005 109.261 177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.43 ' CB ' ' HB ' ' A' ' 113' ' ' ILE . 32.8 t -91.74 156.37 17.61 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 116.454 -0.339 . . . . 75.319999999999993 110.223 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.65 -168.2 38.46 Favored Glycine 0 N--CA 1.44 -1.059 0 C-N-CA 120.754 -0.736 . . . . 41.43 111.525 178.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -66.13 102.46 0.56 Allowed 'Trans proline' 0 C--O 1.241 0.65 0 C-N-CA 122.78 2.32 . . . . 75.310000000000002 112.35 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 61.3 t -94.3 110.95 24.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.675 -0.491 . . . . 60.229999999999997 109.675 178.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 98.8 m-85 -78.08 110.87 13.41 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 116.018 -0.537 . . . . 65.430000000000007 111.004 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 3.9 m -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 108.891 -0.781 . . . . 74.129999999999995 108.891 178.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.416 ' HB2' HH12 ' A' ' 22' ' ' ARG . 7.1 p-10 -60.1 -32.63 71.16 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.082 0.401 . . . . 74.310000000000002 112.082 -178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.4 p -79.36 -35.58 40.68 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.1 0.476 . . . . 54.219999999999999 111.602 -179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.437 ' HA2' ' NE2' ' A' ' 18' ' ' HIS . . . 167.97 -162.88 36.68 Favored Glycine 0 N--CA 1.442 -0.949 0 N-CA-C 110.863 -0.895 . . . . 72.400000000000006 110.863 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.452 HG21 HG13 ' A' ' 43' ' ' ILE . 31.8 mt -87.64 131.75 34.59 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 109.782 -0.451 . . . . 74.209999999999994 109.782 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.62 ' NE2' HD13 ' A' ' 15' ' ' LEU . 14.3 m-70 -121.47 139.65 53.2 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.282 -0.417 . . . . 74.310000000000002 111.163 -178.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.652 HD12 HD23 ' A' ' 14' ' ' LEU . 21.9 mt -109.34 139.5 31.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 108.15 -1.056 . . . . 74.120000000000005 108.15 173.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.507 HG12 ' CD2' ' A' ' 88' ' ' PHE . 23.5 mt -114.68 129.55 70.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 120.744 0.306 . . . . 53.310000000000002 111.606 -175.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 46.8 tp -133.2 119.58 20.05 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.484 -0.561 . . . . 62.25 109.484 174.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -84.2 108.26 16.99 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 120.99 0.424 . . . . 65.219999999999999 109.938 178.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.0 m -70.18 -51.96 27.09 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.626 -0.715 . . . . 62.119999999999997 110.241 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.427 ' HB2' ' HB3' ' A' ' 10' ' ' ARG . 75.0 mm-40 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.39 -0.814 . . . . 61.439999999999998 109.51 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.443 0 N-CA-C 111.709 -0.556 . . . . 75.409999999999997 111.709 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.2 p -64.42 -50.14 68.77 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.201 0.525 . . . . 64.329999999999998 110.792 -179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -114.17 98.18 6.8 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.746 -0.661 . . . . 74.340000000000003 110.326 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 53.5 ttm -130.42 115.0 16.25 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.841 -0.618 . . . . 74.329999999999998 110.463 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.408 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 1.7 mp0 -63.69 141.92 97.97 Favored Pre-proline 0 C--N 1.313 -0.991 0 CA-C-N 115.618 -0.719 . . . . 74.409999999999997 110.305 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -62.32 133.45 43.4 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.682 2.255 . . . . 63.439999999999998 111.846 179.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.64 -47.94 68.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.885 0.374 . . . . 62.450000000000003 110.625 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 84.7 mtt180 -109.97 96.12 6.03 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.453 -0.573 . . . . 73.0 109.453 177.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 14.2 p -109.92 145.33 16.62 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-N 116.205 -0.452 . . . . 51.310000000000002 110.793 -177.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.435 ' HB3' ' HG3' ' A' ' 117' ' ' GLU . 78.8 ttt180 -109.74 120.44 42.49 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.14 -0.482 . . . . 74.519999999999996 110.237 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 59.2 m -134.3 154.47 51.3 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.946 -0.57 . . . . 62.450000000000003 110.403 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.2 m -98.37 149.26 22.83 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.255 -1.017 . . . . 63.530000000000001 108.255 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.561 ' HA ' ' O ' ' A' ' 112' ' ' ILE . 0.3 OUTLIER -148.06 136.96 21.89 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.283 0.564 . . . . 74.209999999999994 112.51 -176.677 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 111' ' ' HIS . 9.5 tt -106.98 140.77 39.25 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.271 -0.877 . . . . 70.420000000000002 108.817 177.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -132.91 127.08 33.54 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 110.054 -0.35 . . . . 61.039999999999999 110.054 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -122.27 127.83 75.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.018 0.437 . . . . 71.409999999999997 110.173 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -91.82 171.8 8.9 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.236 0.541 . . . . 52.409999999999997 111.032 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -152.37 163.03 40.31 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.87 -0.604 . . . . 73.129999999999995 109.848 -178.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.8 t -54.64 -41.63 70.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.253 0.549 . . . . 74.349999999999994 110.189 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -84.01 62.31 6.95 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.873 -0.603 . . . . 74.099999999999994 110.113 177.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.0 t -135.17 165.17 26.01 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.458 -0.571 . . . . 62.409999999999997 109.458 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 73.7 mtm180 -63.2 -34.31 77.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.225 0.536 . . . . 73.510000000000005 110.116 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 40.2 ttm180 -129.98 89.49 45.5 Favored Pre-proline 0 N--CA 1.442 -0.843 0 CA-C-N 115.917 -0.583 . . . . 74.519999999999996 110.47 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.43 72.63 5.9 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.657 2.238 . . . . 53.310000000000002 111.167 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.3 m -157.36 143.4 17.7 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.964 -0.562 . . . . 60.229999999999997 109.941 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.4 p -144.84 172.58 12.82 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.684 0.278 . . . . 72.5 110.551 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 59.9 p-90 -88.68 -5.19 58.29 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.412 0.625 . . . . 75.0 109.434 177.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.492 ' HD3' ' OD1' ' A' ' 66' ' ' ASP . 43.0 mtp180 -98.63 -48.36 5.01 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.097 -0.956 . . . . 75.239999999999995 111.087 -176.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -114.63 146.93 40.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 116.152 -0.477 . . . . 73.349999999999994 110.56 -175.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -83.58 -47.22 11.52 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 74.549999999999997 110.25 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -121.42 116.96 25.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.381 -0.6 . . . . 51.340000000000003 109.381 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.6 mm -75.98 94.02 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.023 0 CA-C-N 116.176 -0.465 . . . . 72.239999999999995 111.442 -175.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.1 m -87.54 -25.59 23.57 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.279 0.562 . . . . 73.319999999999993 110.096 178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HA ' ' OE2' ' A' ' 38' ' ' GLU . 9.1 ptt180 -60.43 119.47 8.06 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.362 -0.836 . . . . 73.329999999999998 111.834 179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 9.0 t -80.72 -178.14 6.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.878 -0.601 . . . . 55.219999999999999 110.644 179.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -67.16 -35.19 79.15 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.466 -0.334 . . . . 75.120000000000005 110.504 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -64.01 -43.16 96.47 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.3 -0.409 . . . . 62.310000000000002 110.976 179.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 42.4 mt-10 -62.7 -41.37 99.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.425 . . . . 74.219999999999999 110.653 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.505 ' O ' HG12 ' A' ' 43' ' ' ILE . . . -63.11 -40.3 97.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.134 -0.484 . . . . 63.219999999999999 110.21 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.67 -42.46 91.3 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.7 -0.682 . . . . 63.450000000000003 109.974 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -59.54 -42.08 91.5 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.276 -0.42 . . . . 75.230000000000004 110.595 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 38' ' ' GLU . 92.8 mt -62.04 -45.85 91.76 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.973 -0.558 . . . . 75.299999999999997 110.419 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 39' ' ' ALA . 42.9 mm -55.99 -53.15 41.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.155 -0.475 . . . . 74.040000000000006 110.817 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.464 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 88.5 m-20 -59.49 -43.7 93.26 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 116.471 -0.332 . . . . 74.450000000000003 110.592 178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.42 -49.94 71.64 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-N 115.963 -0.562 . . . . 65.129999999999995 112.096 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.472 ' O ' HG13 ' A' ' 50' ' ' ILE . 23.2 m-85 -61.04 -51.96 66.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.327 0.108 . . . . 75.140000000000001 110.784 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.426 HG22 ' HE2' ' A' ' 51' ' ' LYS . 69.7 mt -54.75 -43.29 66.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.829 0.347 . . . . 71.140000000000001 111.117 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 44' ' ' ASN . 14.6 mm100 -63.81 -45.58 88.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.398 -0.365 . . . . 55.140000000000001 111.141 178.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -69.01 -36.26 77.6 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 111.842 0.312 . . . . 64.230000000000004 111.842 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 46' ' ' TYR . 83.9 mt -61.42 -49.74 83.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.71 0.291 . . . . 64.200000000000003 110.744 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HE2' HG22 ' A' ' 47' ' ' ILE . 52.0 mtmt -64.66 -34.94 79.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.205 -0.452 . . . . 72.219999999999999 111.472 -179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 46.8 m -65.51 -31.29 72.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.304 -0.407 . . . . 72.0 111.497 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 104.91 25.65 6.72 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.562 -0.827 . . . . 63.149999999999999 111.826 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -89.24 -75.41 0.44 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.118 0.485 . . . . 40.450000000000003 110.207 179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 50' ' ' ILE . 8.7 mm-40 -109.67 146.3 35.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.66 -0.7 . . . . 70.310000000000002 109.545 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -88.71 159.53 17.76 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 109.643 -0.503 . . . . 74.349999999999994 109.643 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -53.59 -42.01 67.17 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.639 0.257 . . . . 71.510000000000005 111.126 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -71.49 -12.74 61.54 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.386 -0.37 . . . . 74.510000000000005 111.559 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 16.1 m -80.01 -29.75 39.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.056 0.455 . . . . 45.130000000000003 110.313 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.2 -45.86 7.0 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.176 -0.465 . . . . 72.310000000000002 111.42 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.87 -24.99 67.27 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 112.734 0.642 . . . . 72.430000000000007 112.734 -176.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.629 ' OG ' ' HA ' ' A' ' 73' ' ' ARG . 15.0 m -88.91 -3.25 58.79 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 112.312 0.486 . . . . 64.540000000000006 112.312 -177.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -133.5 -47.32 0.82 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.341 0.497 . . . . 73.239999999999995 112.341 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -99.25 23.79 8.76 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.132 0.419 . . . . 71.109999999999999 112.132 -174.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.9 t -112.47 127.63 56.1 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.083 0.468 . . . . 32.109999999999999 110.375 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.492 ' OD1' ' HD3' ' A' ' 28' ' ' ARG . 8.2 m-20 -90.24 65.97 6.48 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.023 -0.535 . . . . 73.129999999999995 110.252 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 66.2 p -155.87 169.17 25.04 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.134 -0.485 . . . . 71.349999999999994 110.173 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.8 m -69.71 -23.71 63.46 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 121.008 0.433 . . . . 74.120000000000005 110.588 -179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 49.1 m -67.27 -15.52 63.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.901 -0.591 . . . . 70.239999999999995 111.73 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -62.34 -30.13 70.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.193 0.52 . . . . 71.219999999999999 110.605 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -84.09 -7.95 59.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.925 -0.579 . . . . 72.219999999999999 109.974 179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -110.41 21.72 16.33 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.583 -0.735 . . . . 65.540000000000006 110.841 -178.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.629 ' HA ' ' OG ' ' A' ' 62' ' ' SER . 26.9 mtp180 69.45 12.93 8.36 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.996 -0.547 . . . . 74.030000000000001 111.699 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.43 -10.31 73.82 Favored Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.211 -0.755 . . . . 71.049999999999997 111.211 -177.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -71.58 129.33 38.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.815 0.34 . . . . 54.020000000000003 110.745 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 76' ' ' LEU . 4.8 tt -89.07 -35.47 16.31 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.166 -0.679 . . . . 74.439999999999998 109.166 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 96.77 -178.02 33.37 Favored Glycine 0 N--CA 1.432 -1.595 0 N-CA-C 110.449 -1.061 . . . . 61.340000000000003 110.449 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -75.08 112.97 11.87 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.925 0.362 . . . . 62.409999999999997 110.132 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -116.03 151.57 35.23 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.814 0.34 . . . . 71.219999999999999 111.301 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 7.6 t -169.53 -169.62 0.95 Allowed 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.267 -0.642 . . . . 62.539999999999999 109.267 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 63.16 18.77 11.22 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.215 0.606 . . . . 74.439999999999998 112.521 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 66.0 33.75 86.43 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.863 -0.684 . . . . 72.510000000000005 112.736 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -83.24 -14.26 53.57 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.894 0.378 . . . . 64.129999999999995 111.027 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 34.5 tpp -115.64 154.27 29.78 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.991 -0.55 . . . . 73.540000000000006 109.586 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -51.45 134.49 28.73 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 123.466 0.479 . . . . 64.310000000000002 111.674 -177.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.538 ' N ' ' HD2' ' A' ' 87' ' ' PRO . 51.7 tptt -56.61 -47.78 98.37 Favored Pre-proline 0 CA--C 1.548 0.88 0 N-CA-C 112.809 0.67 . . . . 54.240000000000002 112.809 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 86' ' ' LYS . 10.1 Cg_endo -54.74 -25.18 41.19 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.257 1.972 . . . . 74.430000000000007 111.979 177.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.472 ' CE2' HG12 ' A' ' 113' ' ' ILE . 41.3 t80 -85.84 -43.47 13.26 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.71 -0.677 . . . . 74.310000000000002 109.33 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -59.6 -51.64 68.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.383 -0.826 . . . . 73.450000000000003 111.31 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.47 ' OD2' ' HE3' ' A' ' 86' ' ' LYS . 8.8 m-20 -54.5 -46.57 73.49 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 116.535 -0.302 . . . . 71.400000000000006 111.078 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.661 ' O ' ' HG ' ' A' ' 95' ' ' LEU . . . -64.68 -42.24 95.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.806 -0.634 . . . . 74.349999999999994 111.347 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 m -65.68 -45.2 83.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.83 0.348 . . . . 71.340000000000003 111.269 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -65.73 -24.83 67.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.158 -0.474 . . . . 73.349999999999994 111.314 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -86.76 -5.38 59.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.283 -0.417 . . . . 41.310000000000002 111.574 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 91' ' ' ALA . 96.6 mt -96.69 143.68 27.42 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.706 0.289 . . . . 72.439999999999998 110.389 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -92.17 -179.73 5.33 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.345 -0.389 . . . . 72.420000000000002 110.245 176.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 19.3 m -64.79 125.12 23.82 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 115.944 -0.571 . . . . 74.409999999999997 110.324 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 80.29 21.55 64.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.901 -0.666 . . . . 62.329999999999998 111.999 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.434 ' HG3' HD22 ' A' ' 95' ' ' LEU . 8.3 tp10 -111.81 143.91 41.98 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.037 0.446 . . . . 72.109999999999999 110.917 -179.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' MET . . . . . . . . . . . . . 57.9 ttp -124.79 134.83 52.63 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.449 -0.796 . . . . 71.430000000000007 109.773 -179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 17.8 p -80.11 -69.0 0.62 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.009 0.433 . . . . 74.109999999999999 111.02 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.428 ' O ' ' HA ' ' A' ' 112' ' ' ILE . . . 139.69 -142.82 13.07 Favored Glycine 0 N--CA 1.435 -1.397 0 N-CA-C 111.188 -0.765 . . . . 72.109999999999999 111.188 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.461 ' HB3' HG21 ' A' ' 43' ' ' ILE . 62.8 Cg_endo -76.45 98.37 1.2 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.552 2.168 . . . . 75.239999999999995 112.933 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 59.5 t -95.08 110.95 24.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.237 -0.653 . . . . 64.439999999999998 109.237 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -82.51 122.94 28.7 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.126 -0.488 . . . . 75.019999999999996 111.834 -177.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.0 p -136.74 174.39 10.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.61 -0.723 . . . . 63.119999999999997 109.669 178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -62.99 -31.2 72.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.932 0.396 . . . . 73.140000000000001 110.961 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 46.4 p -79.76 -5.65 55.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.945 -0.57 . . . . 71.510000000000005 111.793 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 123.1 -156.72 17.52 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.687 -0.768 . . . . 63.299999999999997 111.886 -178.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 48.4 mt -97.62 126.97 50.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 120.588 0.233 . . . . 75.230000000000004 110.387 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.549 ' HA ' ' O ' ' A' ' 14' ' ' LEU . 93.1 m-70 -114.34 135.44 54.08 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.517 -0.311 . . . . 75.340000000000003 111.204 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 45.3 mt -105.75 125.37 61.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 107.915 -1.143 . . . . 71.5 107.915 173.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.472 HG12 ' CE2' ' A' ' 88' ' ' PHE . 32.0 mt -107.71 128.96 62.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.791 0.329 . . . . 65.310000000000002 111.779 -176.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 55.5 tp -131.44 108.88 9.91 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.771 -0.649 . . . . 71.329999999999998 109.589 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -81.43 120.84 25.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.74 0.305 . . . . 75.319999999999993 110.68 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 p -100.05 -29.21 12.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.335 -0.393 . . . . 64.299999999999997 111.278 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' A' ' 10' ' ' ARG . 20.9 mm-40 . . . . . 0 C--O 1.247 0.958 0 CA-C-O 118.485 -0.769 . . . . 52.409999999999997 110.697 179.814 . . . . . . . . 1 1 . 1 stop_ save_